[4-chloranyl-5-(4-methylphenyl)sulfonyloxy-2-(phenylcarbonyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-chloranyl-5-(4-methylphenyl)sulfonyloxy-2-(phenylcarbonyl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2-benzoyl-4-chloro-5-(p-tolylsulfonyloxy)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-benzoyl-4-chloro-5-(4-methylphenyl)sulfonyloxyphenyl] ester IUPAC Name: [2-benzoyl-4-chloro-5-(4-methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-benzoyl-4-chloro-5-tosyloxy-phenyl) ester Formula: C27H21ClO7S2 MolecularWeight: 557.03444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2C(=O)C3=CC=CC=C3)Cl)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2C(=O)C3=CC=CC=C3)Cl)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H21ClO7S2/c1-18-8-12-21(13-9-18)36(30,31)34-25-17-26(35-37(32,33)22-14-10-19(2)11-15-22)24(28)16-23(25)27(29)20-6-4-3-5-7-20/h3-17H,1-2H3