3,5-dimethoxy-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 3,5-dimethoxy-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]benzamide CAS Name: 3,5-dimethoxy-N-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]benzamide IUPAC Name: 3,5-dimethoxy-N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]benzamide Traditional Name: N-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]-3,5-dimethoxy-benzamide Formula: C22H26N4O6 MolecularWeight: 442.46504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H26N4O6/c1-31-19-13-16(14-20(15-19)32-2)22(28)23-8-7-21(27)25-11-9-24(10-12-25)17-3-5-18(6-4-17)26(29)30/h3-6,13-15H,7-12H2,1-2H3,(H,23,28)