[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 6,8-bis(bromanyl)-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 6,8-bis(bromanyl)-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 6,8-dibromo-2-phenyl-quinoline-4-carboxylate CAS Name: 6,8-dibromo-2-phenyl-4-quinolinecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 6,8-dibromo-2-phenylquinoline-4-carboxylate Traditional Name: 6,8-dibromo-2-phenyl-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=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Br)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Br)Br)Br

InChI

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