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

Systemtic Name: 2-methoxyethyl 2-methyl-5-oxidanyl-1-(2-phenylsulfanylethyl)benzo[g]indole-3-carboxylate Openeye Name: 2-methoxyethyl 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 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 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 2-methoxyethyl ester Formula: C25H25NO4S MolecularWeight: 435.5353

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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)OCCOC

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO4S/c1-17-23(25(28)30-14-13-29-2)21-16-22(27)19-10-6-7-11-20(19)24(21)26(17)12-15-31-18-8-4-3-5-9-18/h3-11,16,27H,12-15H2,1-2H3