1-(4-methylphenyl)sulfonylcycloheptane-1-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)sulfonylcycloheptane-1-carboxylic acid Openeye Name: 1-(p-tolylsulfonyl)cycloheptanecarboxylic acid CAS Name: 1-(4-methylphenyl)sulfonyl-1-cycloheptanecarboxylic acid IUPAC Name: 1-(4-methylphenyl)sulfonylcycloheptane-1-carboxylic acid Traditional Name: 1-tosylcycloheptanecarboxylic acid Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2(CCCCCC2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2(CCCCCC2)C(=O)O

InChI

InChI=1S/C15H20O4S/c1-12-6-8-13(9-7-12)20(18,19)15(14(16)17)10-4-2-3-5-11-15/h6-9H,2-5,10-11H2,1H3,(H,16,17)