2-(3-chloranyl-2-methyl-phenyl)sulfanylethanoate

Systemtic Name: 2-(3-chloranyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: 2-(3-chloro-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(3-chloro-2-methylphenyl)thio]acetate IUPAC Name: 2-(3-chloro-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(3-chloro-2-methyl-phenyl)thio]acetate Formula: C9H8ClO2S- MolecularWeight: 215.67662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)SCC(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)SCC(=O)[O-]

InChI

InChI=1S/C9H9ClO2S/c1-6-7(10)3-2-4-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)/p-1