methyl 4-methylsulfonylbutanoate

Systemtic Name: methyl 4-methylsulfonylbutanoate Openeye Name: methyl 4-methylsulfonylbutanoate CAS Name: 4-methylsulfonylbutanoic acid methyl ester IUPAC Name: methyl 4-methylsulfonylbutanoate Traditional Name: 4-mesylbutyric acid methyl ester Formula: C6H12O4S MolecularWeight: 180.22208

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCS(=O)(=O)C

Isomeric SMILES

COC(=O)CCCS(=O)(=O)C

InChI

InChI=1S/C6H12O4S/c1-10-6(7)4-3-5-11(2,8)9/h3-5H2,1-2H3