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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 25 results

Search term: FMPNFDSPHNUFOS (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4940913

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17+,18-,19+,20-,21+/m0/s1
C22H35NO2345.5188303113817
4445133

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15+,16-,17+,18+,19-,20+,21-/m1/s1
C22H35NO2345.5188211600
8143638

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17+,18+,19-,20-,21+/m0/s1
C22H35NO2345.51886400
8535668

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16-,17+,18-,19+,20+,21-/m0/s1
C22H35NO2345.51886400
1168

Double-bond stereo

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3
C22H35NO2345.51884200
23149911

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11-/t14-,15-,16+,17+,18+,19-,20-,21+/m0/s1
C22H35NO2345.51883300
23149939

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11-/t14-,15-,16-,17+,18-,19+,20+,21-/m0/s1
C22H35NO2345.51883300
23149970

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11-/t14-,15-,16+,17+,18-,19+,20-,21+/m0/s1
C22H35NO2345.51883300
23184954

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15+,16-,17+,18+,19-,20+,21-/m0/s1
C22H35NO2345.51883300
23185041

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17+,18-,19+,20-,21+/m1/s1
C22H35NO2345.51883300
23248962

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17-,18-,19+,20-,21+/m0/s1
C22H35NO2345.51883300
32700355

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/t14-,15-,16+,17+,18-,19+,20-,21+/m0/s1
C22H35NO2345.51882100
68057726

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/t14-,15+,16-,17+,18+,19-,20+,21-/m1/s1
C22H35NO2345.51882100
10061183

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17-,18+,19+,20+,21+/m0/s1
C22H35NO2345.51882100
10061185

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17-,18-,19+,20+,21+/m0/s1
C22H35NO2345.51882100
4642875

Double-bond stereo

3 of 8 defined stereocentres - 3/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16?,17?,18?,19+,20?,21?/m0/s1
C22H35NO2345.51882200
8038711

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17+,18-,19-,20-,21+/m0/s1
C22H35NO2345.51882100
75569524

Double-bond stereo

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16+,17?,18-,19+,20-,21+/m0/s1
C22H35NO2345.51881100
118210169

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/b12-11+/t14-,15-,16-,17+,18+,19+,20-,21+/m0/s1
C22H35NO2345.51881100
128948906

Double-bond stereo

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3/t14-,15-,16-,17+,18+,19+,20-,21+/m0/s1
C22H35NO2345.51881100
12

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