methyl 5-(methylsulfonyloxymethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-(methylsulfonyloxymethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-(methylsulfonyloxymethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 5-(methylsulfonyloxymethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-(methylsulfonyloxymethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 5-(methylsulfonyloxymethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid methyl ester Formula: C12H16O5S2 MolecularWeight: 304.38244

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)CCC(C2)COS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC2=C(S1)CCC(C2)COS(=O)(=O)C

InChI

InChI=1S/C12H16O5S2/c1-16-12(13)11-6-9-5-8(3-4-10(9)18-11)7-17-19(2,14)15/h6,8H,3-5,7H2,1-2H3