[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-3,8-dimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-3,8-dimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-fluorophenyl)-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-6-bromo-7-chloro-3,8-dimethyl-quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-3,8-dimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [2-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-fluorophenyl)-2-oxoethyl] 6-bromo-7-chloro-3,8-dimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-bromo-7-chloro-3,8-dimethyl-cinchoninic acid [2-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C33H24BrClFNO4 MolecularWeight: 632.903363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C(=C2N=C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C)Cl)Br)C(=O)OCC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=C(C2=CC(=C(C(=C2N=C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C)Cl)Br)C(=O)OCC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C33H24BrClFNO4/c1-19-29(33(39)41-18-28(38)22-8-12-24(36)13-9-22)26-16-27(34)30(35)20(2)32(26)37-31(19)23-10-14-25(15-11-23)40-17-21-6-4-3-5-7-21/h3-16H,17-18H2,1-2H3