2-[2-(3-methoxyphenyl)cyclohexyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(3-methoxyphenyl)cyclohexyl]sulfanylethanoic acid Openeye Name: 2-[2-(3-methoxyphenyl)cyclohexyl]sulfanylacetic acid CAS Name: 2-[[2-(3-methoxyphenyl)cyclohexyl]thio]acetic acid IUPAC Name: 2-[2-(3-methoxyphenyl)cyclohexyl]sulfanylacetic acid Traditional Name: 2-[[2-(3-methoxyphenyl)cyclohexyl]thio]acetic acid Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCCCC2SCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2CCCCC2SCC(=O)O

InChI

InChI=1S/C15H20O3S/c1-18-12-6-4-5-11(9-12)13-7-2-3-8-14(13)19-10-15(16)17/h4-6,9,13-14H,2-3,7-8,10H2,1H3,(H,16,17)