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

Systemtic Name: 4-(3-chloranyl-4-phenyl-phenyl)-3-ethanoylsulfanyl-2-methyl-butanoic acid Openeye Name: 3-acetylsulfanyl-4-(3-chloro-4-phenyl-phenyl)-2-methyl-butanoic acid CAS Name: 3-(acetylthio)-4-(3-chloro-4-phenylphenyl)-2-methylbutanoic acid IUPAC Name: 3-acetylsulfanyl-4-(3-chloro-4-phenylphenyl)-2-methylbutanoic acid Traditional Name: 3-(acetylthio)-4-(3-chloro-4-phenyl-phenyl)-2-methyl-butyric acid Formula: C19H19ClO3S MolecularWeight: 362.87036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC(=C(C=C1)C2=CC=CC=C2)Cl)SC(=O)C)C(=O)O

Isomeric SMILES

CC(C(CC1=CC(=C(C=C1)C2=CC=CC=C2)Cl)SC(=O)C)C(=O)O

InChI

InChI=1S/C19H19ClO3S/c1-12(19(22)23)18(24-13(2)21)11-14-8-9-16(17(20)10-14)15-6-4-3-5-7-15/h3-10,12,18H,11H2,1-2H3,(H,22,23)