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

Systemtic Name: 4-chloranyl-4-(4-phenyl-3-sulfanyl-phenyl)butanoic acid Openeye Name: 4-chloro-4-(4-phenyl-3-sulfanyl-phenyl)butanoic acid CAS Name: 4-chloro-4-(3-mercapto-4-phenylphenyl)butanoic acid IUPAC Name: 4-chloro-4-(4-phenyl-3-sulfanylphenyl)butanoic acid Traditional Name: 4-chloro-4-(3-mercapto-4-phenyl-phenyl)butyric acid Formula: C16H15ClO2S MolecularWeight: 306.8071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClO2S/c17-14(8-9-16(18)19)12-6-7-13(15(20)10-12)11-4-2-1-3-5-11/h1-7,10,14,20H,8-9H2,(H,18,19)