2-(chloromethyl)-3-methylsulfanyl-1-benzothiophene-5-carboxylic acid

Systemtic Name: 2-(chloromethyl)-3-methylsulfanyl-1-benzothiophene-5-carboxylic acid Openeye Name: 2-(chloromethyl)-3-methylsulfanyl-benzothiophene-5-carboxylic acid CAS Name: 2-(chloromethyl)-3-(methylthio)-1-benzothiophene-5-carboxylic acid IUPAC Name: 2-(chloromethyl)-3-methylsulfanyl-1-benzothiophene-5-carboxylic acid Traditional Name: 2-(chloromethyl)-3-(methylthio)benzothiophene-5-carboxylic acid Formula: C11H9ClO2S2 MolecularWeight: 272.77096

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(SC2=C1C=C(C=C2)C(=O)O)CCl

Isomeric SMILES

CSC1=C(SC2=C1C=C(C=C2)C(=O)O)CCl

InChI

InChI=1S/C11H9ClO2S2/c1-15-10-7-4-6(11(13)14)2-3-8(7)16-9(10)5-12/h2-4H,5H2,1H3,(H,13,14)