(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl quinoline-2-carboxylate

Systemtic Name: (9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl quinoline-2-carboxylate Openeye Name: (9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C20H15N3O3 MolecularWeight: 345.3514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H15N3O3/c1-13-5-4-10-23-18(24)11-15(21-19(13)23)12-26-20(25)17-9-8-14-6-2-3-7-16(14)22-17/h2-11H,12H2,1H3