5-cyano-6-(4-methylphenyl)-2-phenyl-pyrimidin-4-olate

Systemtic Name: 5-cyano-6-(4-methylphenyl)-2-phenyl-pyrimidin-4-olate Openeye Name: 5-cyano-2-phenyl-6-(p-tolyl)pyrimidin-4-olate CAS Name: 5-cyano-6-(4-methylphenyl)-2-phenyl-4-pyrimidinolate IUPAC Name: 5-cyano-6-(4-methylphenyl)-2-phenylpyrimidin-4-olate Traditional Name: 5-cyano-2-phenyl-6-(p-tolyl)pyrimidin-4-olate Formula: C18H12N3O- MolecularWeight: 286.30738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)C3=CC=CC=C3)[O-])C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=N2)C3=CC=CC=C3)[O-])C#N

InChI

InChI=1S/C18H13N3O/c1-12-7-9-13(10-8-12)16-15(11-19)18(22)21-17(20-16)14-5-3-2-4-6-14/h2-10H,1H3,(H,20,21,22)/p-1