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

Systemtic Name: (9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-(4-methoxyphenoxy)butanoate Openeye Name: (9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-(4-methoxyphenoxy)butanoate CAS Name: 4-(4-methoxyphenoxy)butanoic 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 4-(4-methoxyphenoxy)butanoate Traditional Name: 4-(4-methoxyphenoxy)butyric acid (4-keto-9-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=CN2C1=NC(=CC2=O)COC(=O)CCCOC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)CCCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O5/c1-15-5-3-11-23-19(24)13-16(22-21(15)23)14-28-20(25)6-4-12-27-18-9-7-17(26-2)8-10-18/h3,5,7-11,13H,4,6,12,14H2,1-2H3