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

Systemtic Name: 4-(3-chloranyl-4-cyclohexyl-phenyl)-2-ethanoylsulfanyl-2-methyl-butanoic acid Openeye Name: 2-acetylsulfanyl-4-(3-chloro-4-cyclohexyl-phenyl)-2-methyl-butanoic acid CAS Name: 2-(acetylthio)-4-(3-chloro-4-cyclohexylphenyl)-2-methylbutanoic acid IUPAC Name: 2-acetylsulfanyl-4-(3-chloro-4-cyclohexylphenyl)-2-methylbutanoic acid Traditional Name: 2-(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(=O)SC(C)(CCC1=CC(=C(C=C1)C2CCCCC2)Cl)C(=O)O

Isomeric SMILES

CC(=O)SC(C)(CCC1=CC(=C(C=C1)C2CCCCC2)Cl)C(=O)O

InChI

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