(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-(2-methoxyphenoxy)propanoate

Systemtic Name: (7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-(2-methoxyphenoxy)propanoate Openeye Name: (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-(2-methoxyphenoxy)propanoate CAS Name: 3-(2-methoxyphenoxy)propanoic acid (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 3-(2-methoxyphenoxy)propanoate Traditional Name: 3-(2-methoxyphenoxy)propionic acid (4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C20H21N2O5+ MolecularWeight: 369.39114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC(=O)CCOC3=CC=CC=C3OC

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC(=O)CCOC3=CC=CC=C3OC

InChI

InChI=1S/C20H20N2O5/c1-14-7-8-18-21-15(11-19(23)22(18)12-14)13-27-20(24)9-10-26-17-6-4-3-5-16(17)25-2/h3-8,11-12H,9-10,13H2,1-2H3/p+1