(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-methylphenyl)-3-phenyl-pyrazole-4-carboxylate

Systemtic Name: (4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-methylphenyl)-3-phenyl-pyrazole-4-carboxylate Openeye Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-phenyl-1-(p-tolyl)pyrazole-4-carboxylate CAS Name: 1-(4-methylphenyl)-3-phenyl-4-pyrazolecarboxylic acid (4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 1-(4-methylphenyl)-3-phenylpyrazole-4-carboxylate Traditional Name: 3-phenyl-1-(p-tolyl)pyrazole-4-carboxylic acid (4-ketopyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3)C(=O)OCC4=CC(=O)N5C=CC=CC5=N4

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3)C(=O)OCC4=CC(=O)N5C=CC=CC5=N4

InChI

InChI=1S/C26H20N4O3/c1-18-10-12-21(13-11-18)30-16-22(25(28-30)19-7-3-2-4-8-19)26(32)33-17-20-15-24(31)29-14-6-5-9-23(29)27-20/h2-16H,17H2,1H3