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

Systemtic Name: 3-acetyloxy-4-methyl-5-(4-methylphenyl)sulfonyloxy-cyclohexane-1-carboxylic acid Openeye Name: 3-acetoxy-4-methyl-5-(p-tolylsulfonyloxy)cyclohexanecarboxylic acid CAS Name: 3-acetyloxy-4-methyl-5-(4-methylphenyl)sulfonyloxy-1-cyclohexanecarboxylic acid IUPAC Name: 3-acetyloxy-4-methyl-5-(4-methylphenyl)sulfonyloxycyclohexane-1-carboxylic acid Traditional Name: 3-acetoxy-4-methyl-5-tosyloxy-cyclohexanecarboxylic acid Formula: C17H22O7S MolecularWeight: 370.41738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O7S/c1-10-4-6-14(7-5-10)25(21,22)24-16-9-13(17(19)20)8-15(11(16)2)23-12(3)18/h4-7,11,13,15-16H,8-9H2,1-3H3,(H,19,20)