3-nitro-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-N-phenyl-benzenesulfonamide

Systemtic Name: 3-nitro-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-N-phenyl-benzenesulfonamide Openeye Name: 3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]-N-phenyl-benzenesulfonamide CAS Name: 3-nitro-4-[3-(2-oxo-1-pyrrolidinyl)propylamino]-N-phenylbenzenesulfonamide IUPAC Name: 3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]-N-phenylbenzenesulfonamide Traditional Name: 4-[3-(2-ketopyrrolidino)propylamino]-3-nitro-N-phenyl-benzenesulfonamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CCCNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c24-19-8-4-12-22(19)13-5-11-20-17-10-9-16(14-18(17)23(25)26)29(27,28)21-15-6-2-1-3-7-15/h1-3,6-7,9-10,14,20-21H,4-5,8,11-13H2