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

Systemtic Name: N-tert-butyl-4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[2-(1H-indol-3-yl)ethylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[2-(1H-indol-3-yl)ethylamino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-benzenesulfonamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4S/c1-20(2,3)23-29(27,28)15-8-9-18(19(12-15)24(25)26)21-11-10-14-13-22-17-7-5-4-6-16(14)17/h4-9,12-13,21-23H,10-11H2,1-3H3