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

Systemtic Name: [2-[4-(2-chlorophenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-3,7,8-trimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-(2-chlorobenzoyl)oxyphenyl]-2-oxo-ethyl] 6-bromo-3,7,8-trimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-3,7,8-trimethyl-2-phenyl-4-quinolinecarboxylic acid [2-[4-[(2-chlorophenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(2-chlorobenzoyl)oxyphenyl]-2-oxoethyl] 6-bromo-3,7,8-trimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-3,7,8-trimethyl-2-phenyl-cinchoninic acid [2-[4-(2-chlorobenzoyl)oxyphenyl]-2-keto-ethyl] ester Formula: C34H25BrClNO5 MolecularWeight: 642.923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C(C(=NC2=C1C)C3=CC=CC=C3)C)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5Cl)Br

Isomeric SMILES

CC1=C(C=C2C(=C(C(=NC2=C1C)C3=CC=CC=C3)C)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5Cl)Br

InChI

InChI=1S/C34H25BrClNO5/c1-19-20(2)32-26(17-27(19)35)30(21(3)31(37-32)23-9-5-4-6-10-23)34(40)41-18-29(38)22-13-15-24(16-14-22)42-33(39)25-11-7-8-12-28(25)36/h4-17H,18H2,1-3H3