[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 6-bromanyl-2-(4-chlorophenyl)-8-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 6-bromanyl-2-(4-chlorophenyl)-8-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 6-bromo-2-(4-chlorophenyl)-8-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-chlorophenyl)-8-ethyl-3-methyl-4-quinolinecarboxylic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 6-bromo-2-(4-chlorophenyl)-8-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-chlorophenyl)-8-ethyl-3-methyl-cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C34H27BrClNO4 MolecularWeight: 628.93948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)Br)C(=C(C(=N2)C3=CC=C(C=C3)Cl)C)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCC1=C2C(=CC(=C1)Br)C(=C(C(=N2)C3=CC=C(C=C3)Cl)C)C(=O)OCC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C34H27BrClNO4/c1-3-23-17-26(35)18-29-31(21(2)32(37-33(23)29)25-9-13-27(36)14-10-25)34(39)41-20-30(38)24-11-15-28(16-12-24)40-19-22-7-5-4-6-8-22/h4-18H,3,19-20H2,1-2H3