[2-[4-(3,4-dichlorophenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-7,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(3,4-dichlorophenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-7,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-(3,4-dichlorobenzoyl)oxyphenyl]-2-oxo-ethyl] 6-bromo-7,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-7,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid [2-[4-[(3,4-dichlorophenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3,4-dichlorobenzoyl)oxyphenyl]-2-oxoethyl] 6-bromo-7,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-7,8-dimethyl-2-phenyl-cinchoninic acid [2-[4-(3,4-dichlorobenzoyl)oxyphenyl]-2-keto-ethyl] ester Formula: C33H22BrCl2NO5 MolecularWeight: 663.34148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=NC2=C1C)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC(=C(C=C5)Cl)Cl)Br

Isomeric SMILES

CC1=C(C=C2C(=CC(=NC2=C1C)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC(=C(C=C5)Cl)Cl)Br

InChI

InChI=1S/C33H22BrCl2NO5/c1-18-19(2)31-24(15-26(18)34)25(16-29(37-31)20-6-4-3-5-7-20)33(40)41-17-30(38)21-8-11-23(12-9-21)42-32(39)22-10-13-27(35)28(36)14-22/h3-16H,17H2,1-2H3