[2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-bromanyl-7-chloranyl-8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-acetoxyphenyl)-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-6-bromo-7-chloro-8-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-7-chloro-8-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [2-(4-acetyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyloxyphenyl)-2-oxoethyl] 6-bromo-7-chloro-8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-bromo-7-chloro-8-methyl-cinchoninic acid [2-(4-acetoxyphenyl)-2-keto-ethyl] ester Formula: C34H25BrClNO6 MolecularWeight: 658.9224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1Cl)Br)C(=CC(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)OCC(=O)C5=CC=C(C=C5)OC(=O)C

Isomeric SMILES

CC1=C2C(=CC(=C1Cl)Br)C(=CC(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)OCC(=O)C5=CC=C(C=C5)OC(=O)C

InChI

InChI=1S/C34H25BrClNO6/c1-20-32(36)29(35)16-27-28(34(40)42-19-31(39)24-10-14-26(15-11-24)43-21(2)38)17-30(37-33(20)27)23-8-12-25(13-9-23)41-18-22-6-4-3-5-7-22/h3-17H,18-19H2,1-2H3