N-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: N-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxo-propyl]benzamide CAS Name: N-[3-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]benzamide IUPAC Name: N-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]benzamide Traditional Name: N-[3-keto-3-[4-(3-nitrophenyl)sulfonylpiperazino]propyl]benzamide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CCNC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6S/c25-19(9-10-21-20(26)16-5-2-1-3-6-16)22-11-13-23(14-12-22)31(29,30)18-8-4-7-17(15-18)24(27)28/h1-8,15H,9-14H2,(H,21,26)