2-(4-methylphenyl)sulfanylcyclohexene-1-carboxylic acid

Systemtic Name: 2-(4-methylphenyl)sulfanylcyclohexene-1-carboxylic acid Openeye Name: 2-(p-tolylsulfanyl)cyclohexene-1-carboxylic acid CAS Name: 2-[(4-methylphenyl)thio]-1-cyclohexenecarboxylic acid IUPAC Name: 2-(4-methylphenyl)sulfanylcyclohexene-1-carboxylic acid Traditional Name: 2-(p-tolylthio)cyclohexene-1-carboxylic acid Formula: C14H16O2S MolecularWeight: 248.34064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(CCCC2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(CCCC2)C(=O)O

InChI

InChI=1S/C14H16O2S/c1-10-6-8-11(9-7-10)17-13-5-3-2-4-12(13)14(15)16/h6-9H,2-5H2,1H3,(H,15,16)