5-methyl-1-benzothiophene-2-sulfonic acid

Systemtic Name: 5-methyl-1-benzothiophene-2-sulfonic acid Openeye Name: 5-methylbenzothiophene-2-sulfonic acid CAS Name: 5-methyl-1-benzothiophene-2-sulfonic acid IUPAC Name: 5-methyl-1-benzothiophene-2-sulfonic acid Traditional Name: 5-methylbenzothiophene-2-sulfonic acid Formula: C9H8O3S2 MolecularWeight: 228.28802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=C2)S(=O)(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=C2)S(=O)(=O)O

InChI

InChI=1S/C9H8O3S2/c1-6-2-3-8-7(4-6)5-9(13-8)14(10,11)12/h2-5H,1H3,(H,10,11,12)