[2-oxidanylidene-2-[4-(phenylcarbonyloxy)phenyl]ethyl] 6-bromanyl-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylcarbonyloxy)phenyl]ethyl] 6-bromanyl-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-benzoyloxyphenyl)-2-oxo-ethyl] 6-bromo-3,8-dimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-bromo-3,8-dimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(4-benzoyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-benzoyloxyphenyl)-2-oxoethyl] 6-bromo-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-3,8-dimethyl-2-(p-tolyl)cinchoninic acid [2-(4-benzoyloxyphenyl)-2-keto-ethyl] ester Formula: C34H26BrNO5 MolecularWeight: 608.47794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5)Br)C

InChI

InChI=1S/C34H26BrNO5/c1-20-9-11-24(12-10-20)32-22(3)30(28-18-26(35)17-21(2)31(28)36-32)34(39)40-19-29(37)23-13-15-27(16-14-23)41-33(38)25-7-5-4-6-8-25/h4-18H,19H2,1-3H3