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

Systemtic Name: [2-[4-(4-methylphenyl)carbonyloxyphenyl]-2-oxidanylidene-ethyl] 6-chloranyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxo-ethyl] 6-chloro-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-chloro-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-[4-[(4-methylphenyl)-oxomethoxy]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylbenzoyl)oxyphenyl]-2-oxoethyl] 6-chloro-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-chloro-2-(p-tolyl)cinchoninic acid [2-keto-2-(4-p-toluoyloxyphenyl)ethyl] ester Formula: C33H24ClNO5 MolecularWeight: 550.00036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C33H24ClNO5/c1-20-3-7-22(8-4-20)30-18-28(27-17-25(34)13-16-29(27)35-30)33(38)39-19-31(36)23-11-14-26(15-12-23)40-32(37)24-9-5-21(2)6-10-24/h3-18H,19H2,1-2H3