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3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxylic acid

3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxylic acid

Systemtic Name:3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxylic acid
Openeye Name:3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxylic acid
CAS Name:3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxylic acid
IUPAC Name:3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carboxylic acid
Traditional Name:3-mesyl-6,7-dihydroisobenzothiophene-1-carboxylic acid
Formula: C10H10O4S2
MolecularWeight: 258.314
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C2C=CCCC2=C(S1)C(=O)O


Isomeric SMILES

CS(=O)(=O)C1=C2C=CCCC2=C(S1)C(=O)O


InChI

InChI=1S/C10H10O4S2/c1-16(13,14)10-7-5-3-2-4-6(7)8(15-10)9(11)12/h3,5H,2,4H2,1H3,(H,11,12)


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