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

Systemtic Name: N,N-diethyl-3-nitro-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[3-(2-oxo-1-pyrrolidinyl)propylamino]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-(2-ketopyrrolidino)propylamino]-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)NCCCN2CCCC2=O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCCN2CCCC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O5S/c1-3-20(4-2)27(25,26)14-8-9-15(16(13-14)21(23)24)18-10-6-12-19-11-5-7-17(19)22/h8-9,13,18H,3-7,10-12H2,1-2H3