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

Systemtic Name: ethyl 4-[2,4-bis(oxidanylidene)-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl]benzoate Openeye Name: ethyl 4-(2,4-dioxo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoate CAS Name: 4-(2,4-dioxo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2,4-dioxo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoate Traditional Name: 4-(2,4-diketo-1H-pyrimido[4,5-b]quinolin-10-ium-10-yl)benzoic acid ethyl ester Formula: C20H16N3O4+ MolecularWeight: 362.35874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O4/c1-2-27-19(25)12-7-9-14(10-8-12)23-16-6-4-3-5-13(16)11-15-17(23)21-20(26)22-18(15)24/h3-11H,2H2,1H3,(H,22,24,26)/p+1