2-(4-cyclohexyl-2-methoxy-phenyl)ethanethioic S-acid

Systemtic Name: 2-(4-cyclohexyl-2-methoxy-phenyl)ethanethioic S-acid Openeye Name: 2-(4-cyclohexyl-2-methoxy-phenyl)ethanethioic S-acid CAS Name: 2-(4-cyclohexyl-2-methoxyphenyl)ethanethioic S-acid IUPAC Name: 2-(4-cyclohexyl-2-methoxyphenyl)ethanethioic S-acid Traditional Name: 2-(4-cyclohexyl-2-methoxy-phenyl)thioacetic acid Formula: C15H20O2S MolecularWeight: 264.3831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2CCCCC2)CC(=O)S

Isomeric SMILES

COC1=C(C=CC(=C1)C2CCCCC2)CC(=O)S

InChI

InChI=1S/C15H20O2S/c1-17-14-9-12(11-5-3-2-4-6-11)7-8-13(14)10-15(16)18/h7-9,11H,2-6,10H2,1H3,(H,16,18)