(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-4-methoxy-benzoate

Systemtic Name: (6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-4-methoxy-benzoate Openeye Name: (6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-4-methoxy-benzoate CAS Name: 3-(ethoxymethyl)-4-methoxybenzoic acid (6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-(ethoxymethyl)-4-methoxybenzoate Traditional Name: 3-(ethoxymethyl)-4-methoxy-benzoic acid (4-keto-6-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C=CC(=C1)C(=O)OCC2=CC(=O)N3C(=CC=CC3=N2)C)OC

Isomeric SMILES

CCOCC1=C(C=CC(=C1)C(=O)OCC2=CC(=O)N3C(=CC=CC3=N2)C)OC

InChI

InChI=1S/C21H22N2O5/c1-4-27-12-16-10-15(8-9-18(16)26-3)21(25)28-13-17-11-20(24)23-14(2)6-5-7-19(23)22-17/h5-11H,4,12-13H2,1-3H3