4-chloranyl-3-oxidanyl-3-(4-phenylphenyl)butanethioic S-acid

Systemtic Name: 4-chloranyl-3-oxidanyl-3-(4-phenylphenyl)butanethioic S-acid Openeye Name: 4-chloro-3-hydroxy-3-(4-phenylphenyl)butanethioic S-acid CAS Name: 4-chloro-3-hydroxy-3-(4-phenylphenyl)butanethioic S-acid IUPAC Name: 4-chloro-3-hydroxy-3-(4-phenylphenyl)butanethioic S-acid Traditional Name: 4-chloro-3-hydroxy-3-(4-phenylphenyl)thiobutyric acid Formula: C16H15ClO2S MolecularWeight: 306.8071

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)S)(CCl)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)S)(CCl)O

InChI

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