[2-[4-[2-(4-chlorophenyl)ethanoyloxy]phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-[2-(4-chlorophenyl)ethanoyloxy]phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-[2-(4-chlorophenyl)acetyl]oxyphenyl]-2-oxo-ethyl] 6-bromo-3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-[4-[2-(4-chlorophenyl)-1-oxoethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[2-(4-chlorophenyl)acetyl]oxyphenyl]-2-oxoethyl] 6-bromo-3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-3-methyl-2-phenyl-cinchoninic acid [2-[4-[2-(4-chlorophenyl)acetyl]oxyphenyl]-2-keto-ethyl] ester Formula: C33H23BrClNO5 MolecularWeight: 628.89642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)CC4=CC=C(C=C4)Cl)Br)C5=CC=CC=C5

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)CC4=CC=C(C=C4)Cl)Br)C5=CC=CC=C5

InChI

InChI=1S/C33H23BrClNO5/c1-20-31(27-18-24(34)11-16-28(27)36-32(20)23-5-3-2-4-6-23)33(39)40-19-29(37)22-9-14-26(15-10-22)41-30(38)17-21-7-12-25(35)13-8-21/h2-16,18H,17,19H2,1H3