(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: (6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: (6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic 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-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic 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:

CC1=CC=CC2=NC(=CC(=O)N12)COC(=O)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)COC(=O)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O5/c1-14-5-4-6-19-22-16(12-20(24)23(14)19)13-28-21(25)10-8-15-7-9-17(26-2)18(11-15)27-3/h4-7,9,11-12H,8,10,13H2,1-3H3