[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-(4-bromophenyl)-7-chloranyl-8-methyl-quinoline-4-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-2-(4-bromophenyl)-7-chloranyl-8-methyl-quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 6-bromo-2-(4-bromophenyl)-7-chloro-8-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-bromophenyl)-7-chloro-8-methyl-4-quinolinecarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 6-bromo-2-(4-bromophenyl)-7-chloro-8-methylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-bromophenyl)-7-chloro-8-methyl-cinchoninic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C27H20Br2ClNO3 MolecularWeight: 601.7136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=NC3=C(C(=C(C=C23)Br)Cl)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=NC3=C(C(=C(C=C23)Br)Cl)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H20Br2ClNO3/c1-14-4-6-18(7-5-14)26(32)16(3)34-27(33)21-13-23(17-8-10-19(28)11-9-17)31-25-15(2)24(30)22(29)12-20(21)25/h4-13,16H,1-3H3