[2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-ethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-ethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-6-ethyl-quinoline-4-carboxylate CAS Name: 6-ethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [2-[4-[(4-methylphenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxoethyl] 6-ethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-ethyl-cinchoninic acid [2-keto-2-(4-p-toluoyloxyphenyl)ethyl] ester Formula: C41H33NO6 MolecularWeight: 635.70382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)C)C5=CC=C(C=C5)OCC6=CC=CC=C6

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)C)C5=CC=C(C=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C41H33NO6/c1-3-28-11-22-37-35(23-28)36(24-38(42-37)30-14-18-33(19-15-30)46-25-29-7-5-4-6-8-29)41(45)47-26-39(43)31-16-20-34(21-17-31)48-40(44)32-12-9-27(2)10-13-32/h4-24H,3,25-26H2,1-2H3