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

Systemtic Name: 4-(3-chloranyl-4-phenyl-phenyl)-4-ethanoylsulfanyl-butanoic acid Openeye Name: 4-acetylsulfanyl-4-(3-chloro-4-phenyl-phenyl)butanoic acid CAS Name: 4-(acetylthio)-4-(3-chloro-4-phenylphenyl)butanoic acid IUPAC Name: 4-acetylsulfanyl-4-(3-chloro-4-phenylphenyl)butanoic acid Traditional Name: 4-(acetylthio)-4-(3-chloro-4-phenyl-phenyl)butyric acid Formula: C18H17ClO3S MolecularWeight: 348.84378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClO3S/c1-12(20)23-17(9-10-18(21)22)14-7-8-15(16(19)11-14)13-5-3-2-4-6-13/h2-8,11,17H,9-10H2,1H3,(H,21,22)