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

Systemtic Name: 6-(4-methylphenyl)-3-[(4-nitrophenyl)methyl]pyrimidin-4-one Openeye Name: 3-[(4-nitrophenyl)methyl]-6-(p-tolyl)pyrimidin-4-one CAS Name: 6-(4-methylphenyl)-3-[(4-nitrophenyl)methyl]-4-pyrimidinone IUPAC Name: 6-(4-methylphenyl)-3-[(4-nitrophenyl)methyl]pyrimidin-4-one Traditional Name: 3-(4-nitrobenzyl)-6-(p-tolyl)pyrimidin-4-one Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3/c1-13-2-6-15(7-3-13)17-10-18(22)20(12-19-17)11-14-4-8-16(9-5-14)21(23)24/h2-10,12H,11H2,1H3