[2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-3,6-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-3,6-dimethyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-[4-(p-tolylsulfonyloxy)phenyl]ethyl] 2-(4-methoxyphenyl)-3,6-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-3,6-dimethyl-4-quinolinecarboxylic acid [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 2-(4-methoxyphenyl)-3,6-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3,6-dimethyl-cinchoninic acid [2-keto-2-(4-tosyloxyphenyl)ethyl] ester Formula: C34H29NO7S MolecularWeight: 595.66156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=C4C=C(C=CC4=NC(=C3C)C5=CC=C(C=C5)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=C4C=C(C=CC4=NC(=C3C)C5=CC=C(C=C5)OC)C

InChI

InChI=1S/C34H29NO7S/c1-21-5-16-28(17-6-21)43(38,39)42-27-14-8-24(9-15-27)31(36)20-41-34(37)32-23(3)33(25-10-12-26(40-4)13-11-25)35-30-18-7-22(2)19-29(30)32/h5-19H,20H2,1-4H3