4-ethanoylsulfanyl-3-methyl-4-(4-phenylphenyl)butanoic acid

Systemtic Name: 4-ethanoylsulfanyl-3-methyl-4-(4-phenylphenyl)butanoic acid Openeye Name: 4-acetylsulfanyl-3-methyl-4-(4-phenylphenyl)butanoic acid CAS Name: 4-(acetylthio)-3-methyl-4-(4-phenylphenyl)butanoic acid IUPAC Name: 4-acetylsulfanyl-3-methyl-4-(4-phenylphenyl)butanoic acid Traditional Name: 4-(acetylthio)-3-methyl-4-(4-phenylphenyl)butyric acid Formula: C19H20O3S MolecularWeight: 328.4253

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O3S/c1-13(12-18(21)22)19(23-14(2)20)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,13,19H,12H2,1-2H3,(H,21,22)