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

Systemtic Name: [2-[4-[2-(4-methoxyphenyl)ethanoyloxy]phenyl]-2-oxidanylidene-ethyl] 6-bromanyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-[4-[2-(4-methoxyphenyl)acetyl]oxyphenyl]-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-6-bromo-quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-phenylmethoxyphenyl)-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-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-bromo-cinchoninic acid [2-keto-2-[4-[2-(4-methoxyphenyl)acetyl]oxyphenyl]ethyl] ester Formula: C40H30BrNO7 MolecularWeight: 716.5727

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)OCC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C40H30BrNO7/c1-46-31-14-7-26(8-15-31)21-39(44)49-33-18-11-29(12-19-33)38(43)25-48-40(45)35-23-37(42-36-20-13-30(41)22-34(35)36)28-9-16-32(17-10-28)47-24-27-5-3-2-4-6-27/h2-20,22-23H,21,24-25H2,1H3