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

Systemtic Name: methyl 5-(2-methylsulfonyloxyethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-(2-methylsulfonyloxyethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 5-(2-methylsulfonyloxyethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-methylsulfonyloxyethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 5-(2-methylsulfonyloxyethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid methyl ester Formula: C13H18O5S2 MolecularWeight: 318.40902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O5S2/c1-17-13(14)12-8-10-7-9(3-4-11(10)19-12)5-6-18-20(2,15)16/h8-9H,3-7H2,1-2H3