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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 24 results

Search term: OVXLNQAYPUEDSI (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
30783487

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15-,16+,17-,18?,19-,20+,21+,22+/m1/s1
C22H33NO2343.5029121100
390332

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14?,15-,16+,17-,18-,19-,20+,21+,22+/m1/s1
C22H33NO2343.50299900
3679727

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3
C22H33NO2343.502928800
71116339

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15+,16+,17-,18-,19-,20?,21+,22?/m1/s1
C22H33NO2343.50297700
21247699

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15-,16+,17-,18-,19-,20?,21+,22?/m1/s1
C22H33NO2343.50295400
78434168

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15-,16+,17-,18-,19-,20+,21+,22+/m1/s1
C22H33NO2343.50293400
81369516

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14?,15-,16+,17-,18?,19-,20+,21+,22+/m1/s1
C22H33NO2343.50293200
82965715

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15-,16+,17-,18?,19-,20+,21+,22+/m0/s1
C22H33NO2343.50292200
97091865

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15-,16+,17-,18-,19-,20+,21-,22+/m1/s1
C22H33NO2343.50292200
141869

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15+,16-,17+,18+,19+,20?,21-,22?/m0/s1
C22H33NO2343.50292200
57486802

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14-,15-,16+,17-,18?,19-,20+,21+,22+/m1/s1
C22H33NO2343.50292200
62896985

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14+,15-,16+,17-,18-,19-,20+,21+,22?/m1/s1
C22H33NO2343.50292200
4475575

3 of 10 defined stereocentres - 3/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13?,14?,15?,16-,17?,18?,19+,20-,21?,22?/m0/s1
C22H33NO2343.50292200
9285816

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14-,15+,16-,17+,18?,19+,20-,21-,22-/m0/s1
C22H33NO2343.50292100
110803882

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14-,15-,16+,17-,18+,19-,20-,21-,22-/m1/s1
C22H33NO2343.50291100
114392114

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14-,15+,16+,17-,18-,19-,20?,21-,22?/m1/s1
C22H33NO2343.50291100
82827464

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14?,15-,16+,17?,18-,19-,20+,21+,22+/m1/s1
C22H33NO2343.50291100
78432002

9 of 10 defined stereocentres - 9/10 defined
InChI=1/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/t13-,14-,15+,16-,17-,18?,19+,20+,21+,22+/m1/s1
C22H33NO2343.50291100
12

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