4-(3-chloranyl-4-cyclohexyl-phenyl)-4-ethanoylsulfanyl-2-methyl-butanoic acid

Systemtic Name: 4-(3-chloranyl-4-cyclohexyl-phenyl)-4-ethanoylsulfanyl-2-methyl-butanoic acid Openeye Name: 4-acetylsulfanyl-4-(3-chloro-4-cyclohexyl-phenyl)-2-methyl-butanoic acid CAS Name: 4-(acetylthio)-4-(3-chloro-4-cyclohexylphenyl)-2-methylbutanoic acid IUPAC Name: 4-acetylsulfanyl-4-(3-chloro-4-cyclohexylphenyl)-2-methylbutanoic acid Traditional Name: 4-(acetylthio)-4-(3-chloro-4-cyclohexyl-phenyl)-2-methyl-butyric acid Formula: C19H25ClO3S MolecularWeight: 368.918

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC(=C(C=C1)C2CCCCC2)Cl)SC(=O)C)C(=O)O

Isomeric SMILES

CC(CC(C1=CC(=C(C=C1)C2CCCCC2)Cl)SC(=O)C)C(=O)O

InChI

InChI=1S/C19H25ClO3S/c1-12(19(22)23)10-18(24-13(2)21)15-8-9-16(17(20)11-15)14-6-4-3-5-7-14/h8-9,11-12,14,18H,3-7,10H2,1-2H3,(H,22,23)