methyl 4-[2-(2-azanyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoate

Systemtic Name: methyl 4-[2-(2-azanyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoate Openeye Name: methyl 4-[2-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoate CAS Name: 4-[2-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoate Traditional Name: 4-[2-(2-amino-4-keto-1H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]benzoic acid methyl ester Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCC2=CN=C3C(=C2)C(=O)N=C(N3)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCC2=CN=C3C(=C2)C(=O)N=C(N3)N

InChI

InChI=1S/C17H16N4O3/c1-24-16(23)12-6-4-10(5-7-12)2-3-11-8-13-14(19-9-11)20-17(18)21-15(13)22/h4-9H,2-3H2,1H3,(H3,18,19,20,21,22)