3-(2-methoxyethylsulfonylmethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-(2-methoxyethylsulfonylmethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(2-methoxyethylsulfonylmethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(2-methoxyethylsulfonylmethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(2-methoxyethylsulfonylmethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(2-methoxyethylsulfonylmethyl)benzothiophene-2-carboxylic acid Formula: C13H14O5S2 MolecularWeight: 314.37726

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Descriptors Computed from Structure

Canonical SMILES:

COCCS(=O)(=O)CC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

COCCS(=O)(=O)CC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C13H14O5S2/c1-18-6-7-20(16,17)8-10-9-4-2-3-5-11(9)19-12(10)13(14)15/h2-5H,6-8H2,1H3,(H,14,15)