methyl 2-[(3-methanoyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)amino]benzoate

Systemtic Name: methyl 2-[(3-methanoyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)amino]benzoate Openeye Name: methyl 2-[(3-formyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)amino]benzoate CAS Name: 2-[(3-formyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-formyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)amino]benzoate Traditional Name: 2-[(3-formyl-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)amino]benzoic acid methyl ester Formula: C17H14N3O4+ MolecularWeight: 324.31076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC2=C(C(=O)[N+]3=CC=CC=C3N2)C=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC2=C(C(=O)[N+]3=CC=CC=C3N2)C=O

InChI

InChI=1S/C17H13N3O4/c1-24-17(23)11-6-2-3-7-13(11)18-15-12(10-21)16(22)20-9-5-4-8-14(20)19-15/h2-10H,1H3,(H,18,21,22,23)/p+1