4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[2-(1H-indol-3-yl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[2-(1H-indol-3-yl)ethylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C19H22N4O4S MolecularWeight: 402.46738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CNC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CNC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S/c1-13(2)22-28(26,27)15-7-8-18(19(11-15)23(24)25)20-10-9-14-12-21-17-6-4-3-5-16(14)17/h3-8,11-13,20-22H,9-10H2,1-2H3