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

Systemtic Name: 3-acetyloxy-5-(4-methylphenyl)sulfonyloxy-cyclohexane-1-carboxylic acid Openeye Name: 3-acetoxy-5-(p-tolylsulfonyloxy)cyclohexanecarboxylic acid CAS Name: 3-acetyloxy-5-(4-methylphenyl)sulfonyloxy-1-cyclohexanecarboxylic acid IUPAC Name: 3-acetyloxy-5-(4-methylphenyl)sulfonyloxycyclohexane-1-carboxylic acid Traditional Name: 3-acetoxy-5-tosyloxy-cyclohexanecarboxylic acid Formula: C16H20O7S MolecularWeight: 356.3908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(CC(C2)OC(=O)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(CC(C2)OC(=O)C)C(=O)O

InChI

InChI=1S/C16H20O7S/c1-10-3-5-15(6-4-10)24(20,21)23-14-8-12(16(18)19)7-13(9-14)22-11(2)17/h3-6,12-14H,7-9H2,1-2H3,(H,18,19)