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

Systemtic Name: 4-(3-indol-1-ylpropylamino)-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-(3-indol-1-ylpropylamino)-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[3-(1-indolyl)propylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(3-indol-1-ylpropylamino)-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-(3-indol-1-ylpropylamino)-N-methyl-3-nitro-benzenesulfonamide Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCCCN2C=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCCCN2C=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O4S/c1-19-27(25,26)15-7-8-16(18(13-15)22(23)24)20-10-4-11-21-12-9-14-5-2-3-6-17(14)21/h2-3,5-9,12-13,19-20H,4,10-11H2,1H3