(E)-2-cyano-N-(3-methoxypropyl)-3-[2-(2-methylphenoxy)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[2-(2-methylphenoxy)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[2-(2-methylphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[2-(2-methylphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[2-(2-methylphenoxy)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-keto-2-(2-methylphenoxy)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-(3-methoxypropyl)acrylamide Formula: C23H23N4O4+ MolecularWeight: 419.45312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=C(C(=O)[N+]3=CC=CC=C3N2)C=C(C#N)C(=O)NCCCOC

Isomeric SMILES

CC1=CC=CC=C1OC2=C(C(=O)[N+]3=CC=CC=C3N2)/C=C(\C#N)/C(=O)NCCCOC

InChI

InChI=1S/C23H22N4O4/c1-16-8-3-4-9-19(16)31-22-18(23(29)27-12-6-5-10-20(27)26-22)14-17(15-24)21(28)25-11-7-13-30-2/h3-6,8-10,12,14H,7,11,13H2,1-2H3,(H,25,28)/p+1/b17-14+