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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
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Found 57 results

Search term: C22H27ClO3 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4447594


8 of 8 defined stereocentres - 8/8 defined
InChI=1/C22H27ClO3/c1-11(24)22(26)7-5-14-12-9-18(23)17-10-19(25)13-8-16(13)21(17,3)15(12)4-6-20(14,22)2/h9-10,12-16,26H,4-8H2,1-3H3/t12-,13+,14-,15-,16-,20-,21-,22-/m0/s1
C22H27ClO3374.901485123986
28600202

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H27ClO3/c1-5-6-19(20(24)16-11-13-18(23)14-12-16)15-7-9-17(10-8-15)21(25)26-22(2,3)4/h7-14,19-20,24H,5-6H2,1-4H3/t19-,20+/m1/s1
C22H27ClO3374.901281400
1406228

Double-bond stereo
InChI=1/C22H27ClO3/c1-5-7-17-12-22(24)26-20-14-21(19(23)13-18(17)20)25-11-10-16(4)9-6-8-15(2)3/h8,10,12-14H,5-7,9,11H2,1-4H3/b16-10+
C22H27ClO3374.901201300
1756784
InChI=1/C22H27ClO3/c1-3-4-5-6-9-16-12-19-17-10-7-8-11-18(17)22(24)26-21(19)13-20(16)25-14-15(2)23/h12-13H,2-11,14H2,1H3
C22H27ClO3374.901191100
2316253

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H27ClO3/c1-6-22(5,20(24)26-21(2,3)4)25-19-13-9-17(10-14-19)15-16-7-11-18(23)12-8-16/h7-14H,6,15H2,1-5H3
C22H27ClO3374.9009891100
2316251

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H27ClO3/c1-5-16(3)25-21(24)22(4,6-2)26-20-13-9-18(10-14-20)15-17-7-11-19(23)12-8-17/h7-14,16H,5-6,15H2,1-4H3
C22H27ClO3374.900988800
46501

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H27ClO3/c1-4-6-15-22(3,21(24)25-5-2)26-20-13-9-18(10-14-20)16-17-7-11-19(23)12-8-17/h7-14H,4-6,15-16H2,1-3H3
C22H27ClO3374.9018800
46509

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H27ClO3/c1-4-6-15-25-21(24)22(3,5-2)26-20-13-9-18(10-14-20)16-17-7-11-19(23)12-8-17/h7-14H,4-6,15-16H2,1-3H3
C22H27ClO3374.9018800
4642628

4 of 8 defined stereocentres - 4/8 defined
InChI=1/C22H27ClO3/c1-11(24)22(26)7-5-14-12-9-18(23)17-10-19(25)13-8-16(13)21(17,3)15(12)4-6-20(14,22)2/h9-10,12-16,26H,4-8H2,1-3H3/t12?,13-,14?,15?,16?,20+,21+,22+/m1/s1
C22H27ClO3374.9017500
35805017

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H27ClO3/c1-5-6-19(20(24)16-11-13-18(23)14-12-16)15-7-9-17(10-8-15)21(25)26-22(2,3)4/h7-14,19-20,24H,5-6H2,1-4H3
C22H27ClO3374.9015500
2907

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C22H27ClO3/c1-11(24)22(26)7-5-14-12-9-18(23)17-10-19(25)13-8-16(13)21(17,3)15(12)4-6-20(14,22)2/h9-10,12-16,26H,4-8H2,1-3H3
C22H27ClO3374.901520600
1406229

Double-bond stereo
InChI=1/C22H27ClO3/c1-5-7-17-12-22(24)26-20-14-21(19(23)13-18(17)20)25-11-10-16(4)9-6-8-15(2)3/h8,10,12-14H,5-7,9,11H2,1-4H3/b16-10-
C22H27ClO3374.9015300
2316252

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H27ClO3/c1-5-22(4,21(24)25-15-16(2)3)26-20-12-8-18(9-13-20)14-17-6-10-19(23)11-7-17/h6-13,16H,5,14-15H2,1-4H3
C22H27ClO3374.900985600
4944155

Double-bond stereo
InChI=1/C22H27ClO3/c1-7-26-21(24)13-16(3)10-8-9-15(2)11-12-19-17(4)14-20(25-6)18(5)22(19)23/h8-14H,7H2,1-6H3/b10-8-,12-11-,15-9-,16-13-
C22H27ClO3374.9014400
8818523

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H27ClO3/c1-16(2)18-10-14-20(15-11-18)26-21(22(24)25)7-5-3-4-6-17-8-12-19(23)13-9-17/h8-16,21H,3-7H2,1-2H3,(H,24,25)
C22H27ClO3374.9014300
9211321

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H27ClO3/c1-13-10-18-16-5-4-14-11-15(24)6-8-20(14,2)17(16)7-9-21(18,3)22(13,26)19(25)12-23/h6-8,11,13,16,18,26H,4-5,9-10,12H2,1-3H3/t13-,16-,18+,20+,21+,22+/m1/s1
C22H27ClO3374.9014600
12154687
InChI=1/C22H27ClO3/c1-15-13-17(14-16(2)21(15)23)25-12-8-11-20(24)26-19-10-7-6-9-18(19)22(3,4)5/h6-7,9-10,13-14H,8,11-12H2,1-5H3
C22H27ClO3374.9013200
12154689
InChI=1/C22H27ClO3/c1-15-13-19(14-16(2)21(15)23)25-12-6-7-20(24)26-18-10-8-17(9-11-18)22(3,4)5/h8-11,13-14H,6-7,12H2,1-5H3
C22H27ClO3374.9013200
2979149

Double-bond stereo
InChI=1/C22H27ClO3/c1-5-7-17-12-22(24)26-20-14-21(19(23)13-18(17)20)25-11-10-16(4)9-6-8-15(2)3/h8,10,12-14H,5-7,9,11H2,1-4H3
C22H27ClO3374.900983200
549578

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H27ClO3/c1-13(25)26-20-7-6-17-16-5-4-15-10-19(23)14(12-24)11-22(15,3)18(16)8-9-21(17,20)2/h4-5,10,12,16-18,20H,6-9,11H2,1-3H3
C22H27ClO3374.9013400
123

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