2-chloranyl-5-methylsulfanyl-benzoate

Systemtic Name: 2-chloranyl-5-methylsulfanyl-benzoate Openeye Name: 2-chloro-5-methylsulfanyl-benzoate CAS Name: 2-chloro-5-(methylthio)benzoate IUPAC Name: 2-chloro-5-methylsulfanylbenzoate Traditional Name: 2-chloro-5-(methylthio)benzoate Formula: C8H6ClO2S- MolecularWeight: 201.65004

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)[O-]

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)[O-]

InChI

InChI=1S/C8H7ClO2S/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)/p-1