methyl 3-[(3-fluorophenyl)methyl]-4-oxidanylidene-pyrido[3,4-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 3-[(3-fluorophenyl)methyl]-4-oxidanylidene-pyrido[3,4-d]pyrimidine-6-carboxylate Openeye Name: methyl 3-[(3-fluorophenyl)methyl]-4-oxo-pyrido[3,4-d]pyrimidine-6-carboxylate CAS Name: 3-[(3-fluorophenyl)methyl]-4-oxo-6-pyrido[3,4-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-fluorophenyl)methyl]-4-oxopyrido[3,4-d]pyrimidine-6-carboxylate Traditional Name: 3-(3-fluorobenzyl)-4-keto-pyrido[3,4-d]pyrimidine-6-carboxylic acid methyl ester Formula: C16H12FN3O3 MolecularWeight: 313.283183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=C2C(=C1)C(=O)N(C=N2)CC3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=NC=C2C(=C1)C(=O)N(C=N2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C16H12FN3O3/c1-23-16(22)13-6-12-14(7-18-13)19-9-20(15(12)21)8-10-3-2-4-11(17)5-10/h2-7,9H,8H2,1H3