2-[2-(3,4-dimethylphenyl)sulfanylcyclohexyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(3,4-dimethylphenyl)sulfanylcyclohexyl]sulfanylethanoic acid Openeye Name: 2-[2-(3,4-dimethylphenyl)sulfanylcyclohexyl]sulfanylacetic acid CAS Name: 2-[[2-[(3,4-dimethylphenyl)thio]cyclohexyl]thio]acetic acid IUPAC Name: 2-[2-(3,4-dimethylphenyl)sulfanylcyclohexyl]sulfanylacetic acid Traditional Name: 2-[[2-[(3,4-dimethylphenyl)thio]cyclohexyl]thio]acetic acid Formula: C16H22O2S2 MolecularWeight: 310.47468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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