(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 3-cyanobenzoate

Systemtic Name: (4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 3-cyanobenzoate Openeye Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (4-ketopyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C17H11N3O3 MolecularWeight: 305.28754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1)COC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1)COC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H11N3O3/c18-10-12-4-3-5-13(8-12)17(22)23-11-14-9-16(21)20-7-2-1-6-15(20)19-14/h1-9H,11H2