methyl 2-chloranyl-4-methylsulfanyl-benzoate

Systemtic Name: methyl 2-chloranyl-4-methylsulfanyl-benzoate Openeye Name: methyl 2-chloro-4-methylsulfanyl-benzoate CAS Name: 2-chloro-4-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-methylsulfanylbenzoate Traditional Name: 2-chloro-4-(methylthio)benzoic acid methyl ester Formula: C9H9ClO2S MolecularWeight: 216.68456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)SC)Cl

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)SC)Cl

InChI

InChI=1S/C9H9ClO2S/c1-12-9(11)7-4-3-6(13-2)5-8(7)10/h3-5H,1-2H3