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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 18322 results

Search term: C22H26N2O3 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
575243
InChI=1/C22H26N2O3/c25-20(12-7-13-21(26)27)23-14-16-24(17-15-23)22(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,22H,7,12-17H2,(H,26,27)
C22H26N2O3366.4534403300
8412664

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H26N2O3/c1-2-27-22(26)20(14-12-16-8-4-3-5-9-16)23-19-15-13-17-10-6-7-11-18(17)24-21(19)25/h3-11,19-20,23H,2,12-15H2,1H3,(H,24,25)/t19-,20-/m0/s1
C22H26N2O3366.4534371900
391592

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C22H26N2O3/c1-4-21-8-5-10-24-11-9-22(20(21)24)16-7-6-14(26-2)12-17(16)23-18(22)15(13-21)19(25)27-3/h5-8,12,20,23H,4,9-11,13H2,1-3H3/t20-,21-,22-/m0/s1
C22H26N2O3366.4534322900
2107541

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C22H26N2O3/c25-20(26)19(8-16-12-23-18-4-2-1-3-17(16)18)24-21(27)22-9-13-5-14(10-22)7-15(6-13)11-22/h1-4,12-15,19,23H,5-11H2,(H,24,27)(H,25,26)
C22H26N2O3366.45344321700
2300974

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C22H26N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h4-8,13-14,17,20,23H,1,9-12H2,2-3H3/b18-13+/t14-,17-,20+/m0/s1
C22H26N2O3366.4534323100
21400191
InChI=1/C22H26N2O3/c1-3-27-22(26)18-10-8-17(9-11-18)21(25)20-7-5-4-6-19(20)16-24-14-12-23(2)13-15-24/h4-11H,3,12-16H2,1-2H3
C22H26N2O3366.4534312600
21399739
InChI=1/C22H26N2O3/c1-3-27-22(26)19-9-7-18(8-10-19)21(25)20-6-4-5-17(15-20)16-24-13-11-23(2)12-14-24/h4-10,15H,3,11-14,16H2,1-2H3
C22H26N2O3366.4534302500
21400189
InChI=1/C22H26N2O3/c1-3-27-22(26)20-11-7-6-10-19(20)21(25)18-9-5-4-8-17(18)16-24-14-12-23(2)13-15-24/h4-11H,3,12-16H2,1-2H3
C22H26N2O3366.4534292400
4117542

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H26N2O3/c1-16-9-8-10-18(15-16)27-17(2)21(25)23-20-12-5-4-11-19(20)22(26)24-13-6-3-7-14-24/h4-5,8-12,15,17H,3,6-7,13-14H2,1-2H3,(H,23,25)
C22H26N2O3366.45344292100
21399738
InChI=1/C22H26N2O3/c1-3-27-22(26)20-9-5-8-19(15-20)21(25)18-7-4-6-17(14-18)16-24-12-10-23(2)11-13-24/h4-9,14-15H,3,10-13,16H2,1-2H3
C22H26N2O3366.4534292500
21399281
InChI=1/C22H26N2O3/c1-3-27-22(26)20-7-5-4-6-19(20)21(25)18-10-8-17(9-11-18)16-24-14-12-23(2)13-15-24/h4-11H,3,12-16H2,1-2H3
C22H26N2O3366.4534292400
21399283
InChI=1/C22H26N2O3/c1-3-27-22(26)20-10-8-19(9-11-20)21(25)18-6-4-17(5-7-18)16-24-14-12-23(2)13-15-24/h4-11H,3,12-16H2,1-2H3
C22H26N2O3366.4534292400
21400190
InChI=1/C22H26N2O3/c1-3-27-22(26)18-9-6-8-17(15-18)21(25)20-10-5-4-7-19(20)16-24-13-11-23(2)12-14-24/h4-10,15H,3,11-14,16H2,1-2H3
C22H26N2O3366.4534282300
4111188

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H26N2O3/c1-2-20(27-17-11-5-3-6-12-17)21(25)23-19-14-8-7-13-18(19)22(26)24-15-9-4-10-16-24/h3,5-8,11-14,20H,2,4,9-10,15-16H2,1H3,(H,23,25)
C22H26N2O3366.45344281800
514524

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H26N2O3/c1-5-27-19-8-6-18(7-9-19)24-13-17(12-20(24)25)22(26)23-21-15(3)10-14(2)11-16(21)4/h6-11,17H,5,12-13H2,1-4H3,(H,23,26)
C22H26N2O3366.4534281900
944460
InChI=1/C22H26N2O3/c1-2-27-22(26)24-15-13-23(14-16-24)21(25)17-20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,20H,2,13-17H2,1H3
C22H26N2O3366.4534271600
1423584
InChI=1/C22H26N2O3/c1-3-22(4-2)14-15-10-6-7-11-16(15)18-17(19(25)21(27)24(18)22)20(26)23-12-8-5-9-13-23/h6-7,10-11H,3-5,8-9,12-14H2,1-2H3
C22H26N2O3366.4534271700
2268777

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H26N2O3/c1-2-27-21(25)15-20-22(26)23-13-14-24(20)16-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19-20H,2,13-16H2,1H3,(H,23,26)
C22H26N2O3366.45344272000
21399737
InChI=1/C22H26N2O3/c1-3-27-22(26)20-10-5-4-9-19(20)21(25)18-8-6-7-17(15-18)16-24-13-11-23(2)12-14-24/h4-10,15H,3,11-14,16H2,1-2H3
C22H26N2O3366.4534272300
532290

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H26N2O3/c1-4-5-10-26-15-8-6-14(7-9-15)19-16(13-23)21(24)27-18-12-22(2,3)11-17(25)20(18)19/h6-9,19H,4-5,10-12,24H2,1-3H3
C22H26N2O3366.4534261800
12345

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