N-[1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-nitro-benzenesulfonamide Openeye Name: 4-nitro-N-[5-oxo-1-(p-tolyl)pyrrolidin-3-yl]benzenesulfonamide CAS Name: N-[1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[5-keto-1-(p-tolyl)pyrrolidin-3-yl]-4-nitro-benzenesulfonamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-12-2-4-14(5-3-12)19-11-13(10-17(19)21)18-26(24,25)16-8-6-15(7-9-16)20(22)23/h2-9,13,18H,10-11H2,1H3