[2-[4-[2-(4-methoxyphenyl)ethanoyloxy]phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-8-ethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-[2-(4-methoxyphenyl)ethanoyloxy]phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-8-ethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[4-[2-(4-methoxyphenyl)acetyl]oxyphenyl]-2-oxo-ethyl] 6-bromo-8-ethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-8-ethyl-2-phenyl-4-quinolinecarboxylic acid [2-[4-[2-(4-methoxyphenyl)-1-oxoethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[2-(4-methoxyphenyl)acetyl]oxyphenyl]-2-oxoethyl] 6-bromo-8-ethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-8-ethyl-2-phenyl-cinchoninic acid [2-keto-2-[4-[2-(4-methoxyphenyl)acetyl]oxyphenyl]ethyl] ester Formula: C35H28BrNO6 MolecularWeight: 638.50392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)CC5=CC=C(C=C5)OC

Isomeric SMILES

CCC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)CC5=CC=C(C=C5)OC

InChI

InChI=1S/C35H28BrNO6/c1-3-23-18-26(36)19-29-30(20-31(37-34(23)29)24-7-5-4-6-8-24)35(40)42-21-32(38)25-11-15-28(16-12-25)43-33(39)17-22-9-13-27(41-2)14-10-22/h4-16,18-20H,3,17,21H2,1-2H3