methyl 2-(3-chloranylpropylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-(3-chloranylpropylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-(3-chloropropylsulfonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-(3-chloropropylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-chloropropylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-(3-chloropropylsulfonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C13H18ClNO4S2 MolecularWeight: 351.86932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)CCCCl

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)CCCCl

InChI

InChI=1S/C13H18ClNO4S2/c1-19-13(16)11-9-5-2-3-6-10(9)20-12(11)15-21(17,18)8-4-7-14/h15H,2-8H2,1H3