[2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 2-(3-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 2-(3-methoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxo-ethyl] 2-(3-methoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3-methoxyphenyl)-4-quinolinecarboxylic acid [2-[4-[(4-methylphenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxoethyl] 2-(3-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3-methoxyphenyl)cinchoninic acid [2-keto-2-(4-p-toluoyloxyphenyl)ethyl] ester Formula: C33H25NO6 MolecularWeight: 531.5547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OC

InChI

InChI=1S/C33H25NO6/c1-21-10-12-23(13-11-21)32(36)40-25-16-14-22(15-17-25)31(35)20-39-33(37)28-19-30(24-6-5-7-26(18-24)38-2)34-29-9-4-3-8-27(28)29/h3-19H,20H2,1-2H3