[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[(5-bromanylquinolin-8-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[(5-bromanylquinolin-8-yl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-[(5-bromo-8-quinolyl)amino]-4-oxo-butanoate CAS Name: 4-[(5-bromo-8-quinolinyl)amino]-4-oxobutanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-[(5-bromoquinolin-8-yl)amino]-4-oxobutanoate Traditional Name: 4-[(5-bromo-8-quinolyl)amino]-4-keto-butyric acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C21H16Br2N2O4 MolecularWeight: 520.17074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)NC(=O)CCC(=O)OCC(=O)C3=CC=C(C=C3)Br)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)NC(=O)CCC(=O)OCC(=O)C3=CC=C(C=C3)Br)Br

InChI

InChI=1S/C21H16Br2N2O4/c22-14-5-3-13(4-6-14)18(26)12-29-20(28)10-9-19(27)25-17-8-7-16(23)15-2-1-11-24-21(15)17/h1-8,11H,9-10,12H2,(H,25,27)