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

Systemtic Name: methyl 4-[3-(2-azanyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-6-yl)propyl]benzoate Openeye Name: methyl 4-[3-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)propyl]benzoate CAS Name: 4-[3-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(2-amino-4-oxo-1H-pyrido[2,3-d]pyrimidin-6-yl)propyl]benzoate Traditional Name: 4-[3-(2-amino-4-keto-1H-pyrido[2,3-d]pyrimidin-6-yl)propyl]benzoic acid methyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCCC2=CN=C3C(=C2)C(=O)N=C(N3)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCCC2=CN=C3C(=C2)C(=O)N=C(N3)N

InChI

InChI=1S/C18H18N4O3/c1-25-17(24)13-7-5-11(6-8-13)3-2-4-12-9-14-15(20-10-12)21-18(19)22-16(14)23/h5-10H,2-4H2,1H3,(H3,19,20,21,22,23)