[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-bromophenyl)-4-quinolinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-bromophenyl)cinchoninic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C24H14Br3NO3 MolecularWeight: 604.08486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Br)Br

InChI

InChI=1S/C24H14Br3NO3/c25-16-5-1-14(2-6-16)22-12-20(19-11-18(27)9-10-21(19)28-22)24(30)31-13-23(29)15-3-7-17(26)8-4-15/h1-12H,13H2