[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-chlorophenyl)-7,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-chlorophenyl)-7,8-dimethyl-quinoline-4-carboxylate Openeye Name: [2-(4-fluorophenyl)-2-oxo-ethyl] 6-bromo-2-(4-chlorophenyl)-7,8-dimethyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-chlorophenyl)-7,8-dimethyl-4-quinolinecarboxylic acid [2-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-fluorophenyl)-2-oxoethyl] 6-bromo-2-(4-chlorophenyl)-7,8-dimethylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-chlorophenyl)-7,8-dimethyl-cinchoninic acid [2-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C26H18BrClFNO3 MolecularWeight: 526.781423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=NC2=C1C)C3=CC=C(C=C3)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)F)Br

Isomeric SMILES

CC1=C(C=C2C(=CC(=NC2=C1C)C3=CC=C(C=C3)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)F)Br

InChI

InChI=1S/C26H18BrClFNO3/c1-14-15(2)25-20(11-22(14)27)21(12-23(30-25)16-3-7-18(28)8-4-16)26(32)33-13-24(31)17-5-9-19(29)10-6-17/h3-12H,13H2,1-2H3