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

Systemtic Name: (8-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-acetamidobenzoate Openeye Name: (8-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid (8-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid (4-keto-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C19H18N3O4+ MolecularWeight: 352.36392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C=C1)C(=O)C=C(N2)COC(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC2=[N+](C=C1)C(=O)C=C(N2)COC(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H17N3O4/c1-12-7-8-22-17(9-12)21-16(10-18(22)24)11-26-19(25)14-3-5-15(6-4-14)20-13(2)23/h3-10H,11H2,1-2H3,(H,20,23,25)/p+1