4-methyl-3-(4-methylphenyl)sulfonyloxy-5-oxidanyl-cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-3-(4-methylphenyl)sulfonyloxy-5-oxidanyl-cyclohexane-1-carboxylic acid Openeye Name: 3-hydroxy-4-methyl-5-(p-tolylsulfonyloxy)cyclohexanecarboxylic acid CAS Name: 3-hydroxy-4-methyl-5-(4-methylphenyl)sulfonyloxy-1-cyclohexanecarboxylic acid IUPAC Name: 3-hydroxy-4-methyl-5-(4-methylphenyl)sulfonyloxycyclohexane-1-carboxylic acid Traditional Name: 3-hydroxy-4-methyl-5-tosyloxy-cyclohexanecarboxylic acid Formula: C15H20O6S MolecularWeight: 328.3807

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(CC1OS(=O)(=O)C2=CC=C(C=C2)C)C(=O)O)O

Isomeric SMILES

CC1C(CC(CC1OS(=O)(=O)C2=CC=C(C=C2)C)C(=O)O)O

InChI

InChI=1S/C15H20O6S/c1-9-3-5-12(6-4-9)22(19,20)21-14-8-11(15(17)18)7-13(16)10(14)2/h3-6,10-11,13-14,16H,7-8H2,1-2H3,(H,17,18)