N,N-diethyl-3-nitro-4-[(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)amino]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)amino]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[(3-oxo-3-pyrrolidin-1-yl-propyl)amino]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[[3-oxo-3-(1-pyrrolidinyl)propyl]amino]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[(3-keto-3-pyrrolidino-propyl)amino]-3-nitro-benzenesulfonamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCC(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCC(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O5S/c1-3-20(4-2)27(25,26)14-7-8-15(16(13-14)21(23)24)18-10-9-17(22)19-11-5-6-12-19/h7-8,13,18H,3-6,9-12H2,1-2H3