methyl (E)-2-cyano-3-[2-(2-methoxyphenoxy)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[2-(2-methoxyphenoxy)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[2-(2-methoxyphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-(2-methoxyphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[2-(2-methoxyphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-keto-2-(2-methoxyphenoxy)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]acrylic acid methyl ester Formula: C20H16N3O5+ MolecularWeight: 378.35814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(C(=O)[N+]3=CC=CC=C3N2)C=C(C#N)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1OC2=C(C(=O)[N+]3=CC=CC=C3N2)/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C20H15N3O5/c1-26-15-7-3-4-8-16(15)28-18-14(11-13(12-21)20(25)27-2)19(24)23-10-6-5-9-17(23)22-18/h3-11H,1-2H3/p+1/b13-11+