[2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxo-ethyl] 6-bromo-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-methoxyphenyl)-8-methyl-4-quinolinecarboxylic acid [2-[4-[(4-methylphenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxoethyl] 6-bromo-2-(4-methoxyphenyl)-8-methylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-methoxyphenyl)-8-methyl-cinchoninic acid [2-keto-2-(4-p-toluoyloxyphenyl)ethyl] ester Formula: C34H26BrNO6 MolecularWeight: 624.47734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=C(C=C(C=C34)Br)C)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=C(C=C(C=C34)Br)C)C5=CC=C(C=C5)OC

InChI

InChI=1S/C34H26BrNO6/c1-20-4-6-24(7-5-20)33(38)42-27-14-10-23(11-15-27)31(37)19-41-34(39)29-18-30(22-8-12-26(40-3)13-9-22)36-32-21(2)16-25(35)17-28(29)32/h4-18H,19H2,1-3H3