4-nitro-N-[3-oxidanylidene-3-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]propyl]benzamide Openeye Name: 4-nitro-N-[3-oxo-3-(3-pyrrolidin-1-ylsulfonylanilino)propyl]benzamide CAS Name: 4-nitro-N-[3-oxo-3-[3-(1-pyrrolidinylsulfonyl)anilino]propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(3-pyrrolidin-1-ylsulfonylanilino)propyl]benzamide Traditional Name: N-[3-keto-3-(3-pyrrolidinosulfonylanilino)propyl]-4-nitro-benzamide Formula: C20H22N4O6S MolecularWeight: 446.47688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6S/c25-19(10-11-21-20(26)15-6-8-17(9-7-15)24(27)28)22-16-4-3-5-18(14-16)31(29,30)23-12-1-2-13-23/h3-9,14H,1-2,10-13H2,(H,21,26)(H,22,25)