methyl 2,4-bis(oxidanylidene)-1H-pyrimido[4,5-b]quinoline-5-carboxylate

Systemtic Name: methyl 2,4-bis(oxidanylidene)-1H-pyrimido[4,5-b]quinoline-5-carboxylate Openeye Name: methyl 2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxylate CAS Name: 2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxylate Traditional Name: 2,4-diketo-1H-pyrimido[4,5-b]quinoline-5-carboxylic acid methyl ester Formula: C13H9N3O4 MolecularWeight: 271.22826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=NC3=CC=CC=C31)NC(=O)NC2=O

Isomeric SMILES

COC(=O)C1=C2C(=NC3=CC=CC=C31)NC(=O)NC2=O

InChI

InChI=1S/C13H9N3O4/c1-20-12(18)8-6-4-2-3-5-7(6)14-10-9(8)11(17)16-13(19)15-10/h2-5H,1H3,(H2,14,15,16,17,19)