(4-cyanophenyl)methyl 4-oxidanylidenepyrimido[1,2-a]pyrimidine-3-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 4-oxidanylidenepyrimido[1,2-a]pyrimidine-3-carboxylate Openeye Name: (4-cyanophenyl)methyl 4-oxopyrimido[1,2-a]pyrimidine-3-carboxylate CAS Name: 4-oxo-3-pyrimido[1,2-a]pyrimidinecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-oxopyrimido[1,2-a]pyrimidine-3-carboxylate Traditional Name: 4-ketopyrimido[1,2-a]pyrimidine-3-carboxylic acid (4-cyanobenzyl) ester Formula: C16H10N4O3 MolecularWeight: 306.2756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=O)C(=CN=C2N=C1)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CN2C(=O)C(=CN=C2N=C1)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H10N4O3/c17-8-11-2-4-12(5-3-11)10-23-15(22)13-9-19-16-18-6-1-7-20(16)14(13)21/h1-7,9H,10H2