[1-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-3-phenyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [1-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-3-phenyl-propyl] 4-methylbenzenesulfonate Openeye Name: [1-(4-chlorophenyl)-3-oxo-3-phenyl-2-(p-tolylsulfonyloxy)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxy-3-oxo-3-phenylpropyl] ester IUPAC Name: [1-(4-chlorophenyl)-2-(4-methylphenyl)sulfonyloxy-3-oxo-3-phenylpropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-(4-chlorophenyl)-3-keto-3-phenyl-2-tosyloxy-propyl] ester Formula: C29H25ClO7S2 MolecularWeight: 585.0876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C2=CC=C(C=C2)Cl)C(C(=O)C3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C2=CC=C(C=C2)Cl)C(C(=O)C3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H25ClO7S2/c1-20-8-16-25(17-9-20)38(32,33)36-28(23-12-14-24(30)15-13-23)29(27(31)22-6-4-3-5-7-22)37-39(34,35)26-18-10-21(2)11-19-26/h3-19,28-29H,1-2H3