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

Systemtic Name: 4-chloranyl-4-(3-methylsulfinyl-4-phenyl-phenyl)butanoic acid Openeye Name: 4-chloro-4-(3-methylsulfinyl-4-phenyl-phenyl)butanoic acid CAS Name: 4-chloro-4-(3-methylsulfinyl-4-phenylphenyl)butanoic acid IUPAC Name: 4-chloro-4-(3-methylsulfinyl-4-phenylphenyl)butanoic acid Traditional Name: 4-chloro-4-(3-methylsulfinyl-4-phenyl-phenyl)butyric acid Formula: C17H17ClO3S MolecularWeight: 336.83308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClO3S/c1-22(21)16-11-13(15(18)9-10-17(19)20)7-8-14(16)12-5-3-2-4-6-12/h2-8,11,15H,9-10H2,1H3,(H,19,20)