methyl 4-[(E)-2-cyano-2-(4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-2-yl)ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-cyano-2-(4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-2-yl)ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-cyano-2-(4-oxo-1H-pyrido[2,3-d]pyrimidin-2-yl)vinyl]benzoate CAS Name: 4-[(E)-2-cyano-2-(4-oxo-1H-pyrido[2,3-d]pyrimidin-2-yl)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-cyano-2-(4-oxo-1H-pyrido[2,3-d]pyrimidin-2-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-cyano-2-(4-keto-1H-pyrido[2,3-d]pyrimidin-2-yl)vinyl]benzoic acid methyl ester Formula: C18H12N4O3 MolecularWeight: 332.31288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C2=NC(=O)C3=C(N2)N=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC(=O)C3=C(N2)N=CC=C3

InChI

InChI=1S/C18H12N4O3/c1-25-18(24)12-6-4-11(5-7-12)9-13(10-19)15-21-16-14(17(23)22-15)3-2-8-20-16/h2-9H,1H3,(H,20,21,22,23)/b13-9+