dimethyl 5-bromanyl-4-oxidanylidene-1H-quinoline-2,3-dicarboxylate

Systemtic Name: dimethyl 5-bromanyl-4-oxidanylidene-1H-quinoline-2,3-dicarboxylate Openeye Name: dimethyl 5-bromo-4-oxo-1H-quinoline-2,3-dicarboxylate CAS Name: 5-bromo-4-oxo-1H-quinoline-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-bromo-4-oxo-1H-quinoline-2,3-dicarboxylate Traditional Name: 5-bromo-4-keto-1H-quinoline-2,3-dicarboxylic acid dimethyl ester Formula: C13H10BrNO5 MolecularWeight: 340.1262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC2=C(C1=O)C(=CC=C2)Br)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(NC2=C(C1=O)C(=CC=C2)Br)C(=O)OC

InChI

InChI=1S/C13H10BrNO5/c1-19-12(17)9-10(13(18)20-2)15-7-5-3-4-6(14)8(7)11(9)16/h3-5H,1-2H3,(H,15,16)