5-nitro-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1H-pyridin-2-one

Systemtic Name: 5-nitro-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1H-pyridin-2-one Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-5-nitro-1H-pyridin-2-one CAS Name: 5-nitro-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1H-pyridin-2-one IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-5-nitro-1H-pyridin-2-one Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-5-nitro-2-pyridone Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CNC3=O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CNC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c22-16-15(10-14(11-18-16)21(24)25)17(23)20-8-6-19(7-9-20)12-13-4-2-1-3-5-13/h1-5,10-11H,6-9,12H2,(H,18,22)