methyl 3-[2,4-bis(oxidanylidene)-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl]benzoate

Systemtic Name: methyl 3-[2,4-bis(oxidanylidene)-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl]benzoate Openeye Name: methyl 3-(2,4-dioxo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoate CAS Name: 3-(2,4-dioxo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoic acid methyl ester IUPAC Name: methyl 3-(2,4-dioxo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoate Traditional Name: 3-(2,4-diketo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoic acid methyl ester Formula: C19H14N3O4+ MolecularWeight: 348.33216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)[N+]2=C3C(=CC4=CC=CC=C42)C(=O)NC(=O)N3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)[N+]2=C3C(=CC4=CC=CC=C42)C(=O)NC(=O)N3

InChI

InChI=1S/C19H13N3O4/c1-26-18(24)12-6-4-7-13(9-12)22-15-8-3-2-5-11(15)10-14-16(22)20-19(25)21-17(14)23/h2-10H,1H3,(H,21,23,25)/p+1