N-[1H-indol-3-yl-(3-methylphenyl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1H-indol-3-yl-(3-methylphenyl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[1H-indol-3-yl(m-tolyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[1H-indol-3-yl-(3-methylphenyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1H-indol-3-yl-(3-methylphenyl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-[1H-indol-3-yl(m-tolyl)methyl]-4-nitro-benzenesulfonamide Formula: C22H19N3O4S MolecularWeight: 421.46896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4S/c1-15-5-4-6-16(13-15)22(20-14-23-21-8-3-2-7-19(20)21)24-30(28,29)18-11-9-17(10-12-18)25(26)27/h2-14,22-24H,1H3