2-[1-[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[2-(4-methylsulfanylphenyl)-2-oxo-ethyl]cyclohexyl]acetic acid CAS Name: 2-[1-[2-[4-(methylthio)phenyl]-2-oxoethyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[2-(4-methylsulfanylphenyl)-2-oxoethyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[2-keto-2-[4-(methylthio)phenyl]ethyl]cyclohexyl]acetic acid Formula: C17H22O3S MolecularWeight: 306.41978

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CC2(CCCCC2)CC(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CC2(CCCCC2)CC(=O)O

InChI

InChI=1S/C17H22O3S/c1-21-14-7-5-13(6-8-14)15(18)11-17(12-16(19)20)9-3-2-4-10-17/h5-8H,2-4,9-12H2,1H3,(H,19,20)