(2R)-4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxo-butanoate CAS Name: (2R)-4-(4-tert-butylphenyl)-2-(cyclohexylthio)-4-oxobutanoate IUPAC Name: (2R)-4-(4-tert-butylphenyl)-2-cyclohexylsulfanyl-4-oxobutanoate Traditional Name: (2R)-4-(4-tert-butylphenyl)-2-(cyclohexylthio)-4-keto-butyrate Formula: C20H27O3S- MolecularWeight: 347.49158

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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)C[C@H](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)/p-1/t18-/m1/s1