N,N-diethyl-3-nitro-4-[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethoxy]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethoxy]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[2-oxo-2-[2-(2-thienyl)pyrrolidin-1-yl]ethoxy]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[2-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethoxy]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[2-oxo-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethoxy]benzenesulfonamide Traditional Name: N,N-diethyl-4-[2-keto-2-[2-(2-thienyl)pyrrolidino]ethoxy]-3-nitro-benzenesulfonamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CCCC2C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CCCC2C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O6S2/c1-3-21(4-2)31(27,28)15-9-10-18(17(13-15)23(25)26)29-14-20(24)22-11-5-7-16(22)19-8-6-12-30-19/h6,8-10,12-13,16H,3-5,7,11,14H2,1-2H3