3-nitro-5-[(4-phenylpiperazin-1-yl)methyl]-1H-pyridin-2-one

Systemtic Name: 3-nitro-5-[(4-phenylpiperazin-1-yl)methyl]-1H-pyridin-2-one Openeye Name: 3-nitro-5-[(4-phenylpiperazin-1-yl)methyl]-1H-pyridin-2-one CAS Name: 3-nitro-5-[(4-phenyl-1-piperazinyl)methyl]-1H-pyridin-2-one IUPAC Name: 3-nitro-5-[(4-phenylpiperazin-1-yl)methyl]-1H-pyridin-2-one Traditional Name: 3-nitro-5-[(4-phenylpiperazino)methyl]-2-pyridone Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O3/c21-16-15(20(22)23)10-13(11-17-16)12-18-6-8-19(9-7-18)14-4-2-1-3-5-14/h1-5,10-11H,6-9,12H2,(H,17,21)