(2S)-2-(4-chloranyl-3-methyl-phenyl)sulfanylpropanoic acid

Systemtic Name: (2S)-2-(4-chloranyl-3-methyl-phenyl)sulfanylpropanoic acid Openeye Name: (2S)-2-(4-chloro-3-methyl-phenyl)sulfanylpropanoic acid CAS Name: (2S)-2-[(4-chloro-3-methylphenyl)thio]propanoic acid IUPAC Name: (2S)-2-(4-chloro-3-methylphenyl)sulfanylpropanoic acid Traditional Name: (2S)-2-[(4-chloro-3-methyl-phenyl)thio]propionic acid Formula: C10H11ClO2S MolecularWeight: 230.71114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC(C)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)S[C@@H](C)C(=O)O)Cl

InChI

InChI=1S/C10H11ClO2S/c1-6-5-8(3-4-9(6)11)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)/t7-/m0/s1