methyl 2-methyl-5-oxidanyl-1-(2-phenylsulfanylethyl)benzo[g]indole-3-carboxylate

Systemtic Name: methyl 2-methyl-5-oxidanyl-1-(2-phenylsulfanylethyl)benzo[g]indole-3-carboxylate Openeye Name: methyl 5-hydroxy-2-methyl-1-(2-phenylsulfanylethyl)benzo[g]indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-1-[2-(phenylthio)ethyl]-3-benzo[g]indolecarboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-2-methyl-1-(2-phenylsulfanylethyl)benzo[g]indole-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-1-[2-(phenylthio)ethyl]benz[g]indole-3-carboxylic acid methyl ester Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCSC3=CC=CC=C3)C4=CC=CC=C4C(=C2)O)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1CCSC3=CC=CC=C3)C4=CC=CC=C4C(=C2)O)C(=O)OC

InChI

InChI=1S/C23H21NO3S/c1-15-21(23(26)27-2)19-14-20(25)17-10-6-7-11-18(17)22(19)24(15)12-13-28-16-8-4-3-5-9-16/h3-11,14,25H,12-13H2,1-2H3