4-[[1-(diphenylmethyl)-5-nitro-indol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide

Systemtic Name: 4-[[1-(diphenylmethyl)-5-nitro-indol-3-yl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonyl-benzamide Openeye Name: 4-[(1-benzhydryl-5-nitro-indol-3-yl)methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide CAS Name: 4-[[1-(diphenylmethyl)-5-nitro-3-indolyl]methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide IUPAC Name: 4-[(1-benzhydryl-5-nitroindol-3-yl)methyl]-3-methoxy-N-(2-methylphenyl)sulfonylbenzamide Traditional Name: 4-[(1-benzhydryl-5-nitro-indol-3-yl)methyl]-3-methoxy-N-(o-tolylsulfonyl)benzamide Formula: C37H31N3O6S MolecularWeight: 645.72354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CC3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])C(C5=CC=CC=C5)C6=CC=CC=C6)OC

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CC3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])C(C5=CC=CC=C5)C6=CC=CC=C6)OC

InChI

InChI=1S/C37H31N3O6S/c1-25-11-9-10-16-35(25)47(44,45)38-37(41)29-18-17-28(34(22-29)46-2)21-30-24-39(33-20-19-31(40(42)43)23-32(30)33)36(26-12-5-3-6-13-26)27-14-7-4-8-15-27/h3-20,22-24,36H,21H2,1-2H3,(H,38,41)