(E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methylprop-2-enamide Traditional Name: (E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-N-methyl-acrylamide Formula: C22H21N4O3+ MolecularWeight: 389.42714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC2=C(C(=O)[N+]3=CC=CC(=C3N2)C)C=C(C#N)C(=O)NC)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC2=C(C(=O)[N+]3=CC=CC(=C3N2)C)/C=C(\C#N)/C(=O)NC)C

InChI

InChI=1S/C22H20N4O3/c1-13-7-5-9-18(15(13)3)29-21-17(11-16(12-23)20(27)24-4)22(28)26-10-6-8-14(2)19(26)25-21/h5-11H,1-4H3,(H,24,27)/p+1/b16-11+