3-[(4-nitrophenyl)methyl]-6-phenyl-pyrimidin-4-one

Systemtic Name: 3-[(4-nitrophenyl)methyl]-6-phenyl-pyrimidin-4-one Openeye Name: 3-[(4-nitrophenyl)methyl]-6-phenyl-pyrimidin-4-one CAS Name: 3-[(4-nitrophenyl)methyl]-6-phenyl-4-pyrimidinone IUPAC Name: 3-[(4-nitrophenyl)methyl]-6-phenylpyrimidin-4-one Traditional Name: 3-(4-nitrobenzyl)-6-phenyl-pyrimidin-4-one Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3/c21-17-10-16(14-4-2-1-3-5-14)18-12-19(17)11-13-6-8-15(9-7-13)20(22)23/h1-10,12H,11H2