[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-cyclopentyl] 4-methylbenzenesulfonate

Systemtic Name: [1-(4-methylphenyl)sulfonyl-2-oxidanylidene-cyclopentyl] 4-methylbenzenesulfonate Openeye Name: [2-oxo-1-(p-tolylsulfonyl)cyclopentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-methylphenyl)sulfonyl-2-oxocyclopentyl] ester IUPAC Name: [1-(4-methylphenyl)sulfonyl-2-oxocyclopentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-1-tosyl-cyclopentyl) ester Formula: C19H20O6S2 MolecularWeight: 408.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2(CCCC2=O)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2(CCCC2=O)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H20O6S2/c1-14-5-9-16(10-6-14)26(21,22)19(13-3-4-18(19)20)25-27(23,24)17-11-7-15(2)8-12-17/h5-12H,3-4,13H2,1-2H3