4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxo-butanoic acid CAS Name: 4-(4-tert-butylphenyl)-2-(cyclohexylthio)-4-oxobutanoic acid IUPAC Name: 4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxobutanoic acid Traditional Name: 4-(4-tert-butylphenyl)-2-(cyclohexylthio)-4-keto-butyric acid Formula: C20H28O3S MolecularWeight: 348.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)SC2CCCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)SC2CCCCC2

InChI

InChI=1S/C20H28O3S/c1-20(2,3)15-11-9-14(10-12-15)17(21)13-18(19(22)23)24-16-7-5-4-6-8-16/h9-12,16,18H,4-8,13H2,1-3H3,(H,22,23)