methyl 2-chloranylsulfonyl-3-methylsulfanyl-benzoate

Systemtic Name: methyl 2-chloranylsulfonyl-3-methylsulfanyl-benzoate Openeye Name: methyl 2-chlorosulfonyl-3-methylsulfanyl-benzoate CAS Name: 2-chlorosulfonyl-3-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 2-chlorosulfonyl-3-methylsulfanylbenzoate Traditional Name: 2-chlorosulfonyl-3-(methylthio)benzoic acid methyl ester Formula: C9H9ClO4S2 MolecularWeight: 280.74836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClO4S2/c1-14-9(11)6-4-3-5-7(15-2)8(6)16(10,12)13/h3-5H,1-2H3