2-(3-chlorophenyl)-3-methyl-butanethioic S-acid

Systemtic Name: 2-(3-chlorophenyl)-3-methyl-butanethioic S-acid Openeye Name: 2-(3-chlorophenyl)-3-methyl-butanethioic S-acid CAS Name: 2-(3-chlorophenyl)-3-methylbutanethioic S-acid IUPAC Name: 2-(3-chlorophenyl)-3-methylbutanethioic S-acid Traditional Name: 2-(3-chlorophenyl)-3-methyl-thiobutyric acid Formula: C11H13ClOS MolecularWeight: 228.73832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13ClOS/c1-7(2)10(11(13)14)8-4-3-5-9(12)6-8/h3-7,10H,1-2H3,(H,13,14)