N-[7-methoxy-2,9-bis(phenylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indol-6-yl]benzamide

Systemtic Name: N-[7-methoxy-2,9-bis(phenylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indol-6-yl]benzamide Openeye Name: N-[2,9-bis(benzenesulfonyl)-7-methoxy-3,4-dihydro-1H-pyrido[3,4-b]indol-6-yl]benzamide CAS Name: N-[2,9-bis(benzenesulfonyl)-7-methoxy-3,4-dihydro-1H-pyrido[3,4-b]indol-6-yl]benzamide IUPAC Name: N-[2,9-bis(benzenesulfonyl)-7-methoxy-3,4-dihydro-1H-pyrido[3,4-b]indol-6-yl]benzamide Traditional Name: N-(2,9-dibesyl-7-methoxy-3,4-dihydro-1H-$b-carbolin-6-yl)benzamide Formula: C31H27N3O6S2 MolecularWeight: 601.69258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3=C(CN(CC3)S(=O)(=O)C4=CC=CC=C4)N(C2=C1)S(=O)(=O)C5=CC=CC=C5)NC(=O)C6=CC=CC=C6

Isomeric SMILES

COC1=C(C=C2C3=C(CN(CC3)S(=O)(=O)C4=CC=CC=C4)N(C2=C1)S(=O)(=O)C5=CC=CC=C5)NC(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H27N3O6S2/c1-40-30-20-28-26(19-27(30)32-31(35)22-11-5-2-6-12-22)25-17-18-33(41(36,37)23-13-7-3-8-14-23)21-29(25)34(28)42(38,39)24-15-9-4-10-16-24/h2-16,19-20H,17-18,21H2,1H3,(H,32,35)