(9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 2,4-dimethylbenzoate

Systemtic Name: (9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 2,4-dimethylbenzoate Openeye Name: (9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 2,4-dimethylbenzoate CAS Name: 2,4-dimethylbenzoic acid (9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 2,4-dimethylbenzoate Traditional Name: 2,4-dimethylbenzoic acid (4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C19H19N2O3+ MolecularWeight: 323.36576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OCC2=CC(=O)[N+]3=CC=CC(=C3N2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OCC2=CC(=O)[N+]3=CC=CC(=C3N2)C)C

InChI

InChI=1S/C19H18N2O3/c1-12-6-7-16(14(3)9-12)19(23)24-11-15-10-17(22)21-8-4-5-13(2)18(21)20-15/h4-10H,11H2,1-3H3/p+1