1-[(3-nitrophenyl)methyl]-2-oxidanylidene-N-pyrimidin-2-yl-pyridine-3-carboxamide

Systemtic Name: 1-[(3-nitrophenyl)methyl]-2-oxidanylidene-N-pyrimidin-2-yl-pyridine-3-carboxamide Openeye Name: 1-[(3-nitrophenyl)methyl]-2-oxo-N-pyrimidin-2-yl-pyridine-3-carboxamide CAS Name: 1-[(3-nitrophenyl)methyl]-2-oxo-N-(2-pyrimidinyl)-3-pyridinecarboxamide IUPAC Name: 1-[(3-nitrophenyl)methyl]-2-oxo-N-pyrimidin-2-ylpyridine-3-carboxamide Traditional Name: 2-keto-1-(3-nitrobenzyl)-N-(2-pyrimidyl)nicotinamide Formula: C17H13N5O4 MolecularWeight: 351.31622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CN2C=CC=C(C2=O)C(=O)NC3=NC=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CN2C=CC=C(C2=O)C(=O)NC3=NC=CC=N3

InChI

InChI=1S/C17H13N5O4/c23-15(20-17-18-7-3-8-19-17)14-6-2-9-21(16(14)24)11-12-4-1-5-13(10-12)22(25)26/h1-10H,11H2,(H,18,19,20,23)