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

Systemtic Name: methyl 4-methyl-3-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonyl)amino]benzoate CAS Name: 4-methyl-3-[[oxo-(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonyl)amino]benzoate Traditional Name: 3-[(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C18H16N3O4+ MolecularWeight: 338.33734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CNC3=CC=CC=[N+]3C2=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CNC3=CC=CC=[N+]3C2=O

InChI

InChI=1S/C18H15N3O4/c1-11-6-7-12(18(24)25-2)9-14(11)20-16(22)13-10-19-15-5-3-4-8-21(15)17(13)23/h3-10H,1-2H3,(H,20,22)/p+1