4-(3-indol-1-ylpropylamino)-3-nitro-benzenesulfonamide

Systemtic Name: 4-(3-indol-1-ylpropylamino)-3-nitro-benzenesulfonamide Openeye Name: 4-(3-indol-1-ylpropylamino)-3-nitro-benzenesulfonamide CAS Name: 4-[3-(1-indolyl)propylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-(3-indol-1-ylpropylamino)-3-nitrobenzenesulfonamide Traditional Name: 4-(3-indol-1-ylpropylamino)-3-nitro-benzenesulfonamide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCCNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCCNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4S/c18-26(24,25)14-6-7-15(17(12-14)21(22)23)19-9-3-10-20-11-8-13-4-1-2-5-16(13)20/h1-2,4-8,11-12,19H,3,9-10H2,(H2,18,24,25)