2-[2-(2,5-dimethylphenyl)sulfanylcyclohexyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(2,5-dimethylphenyl)sulfanylcyclohexyl]sulfanylethanoic acid Openeye Name: 2-[2-(2,5-dimethylphenyl)sulfanylcyclohexyl]sulfanylacetic acid CAS Name: 2-[[2-[(2,5-dimethylphenyl)thio]cyclohexyl]thio]acetic acid IUPAC Name: 2-[2-(2,5-dimethylphenyl)sulfanylcyclohexyl]sulfanylacetic acid Traditional Name: 2-[[2-[(2,5-dimethylphenyl)thio]cyclohexyl]thio]acetic acid Formula: C16H22O2S2 MolecularWeight: 310.47468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2CCCCC2SCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2CCCCC2SCC(=O)O

InChI

InChI=1S/C16H22O2S2/c1-11-7-8-12(2)15(9-11)20-14-6-4-3-5-13(14)19-10-16(17)18/h7-9,13-14H,3-6,10H2,1-2H3,(H,17,18)