5-[2-(dimethylamino)ethanoyl]thiophene-3-sulfonic acid

Systemtic Name: 5-[2-(dimethylamino)ethanoyl]thiophene-3-sulfonic acid Openeye Name: 5-[2-(dimethylamino)acetyl]thiophene-3-sulfonic acid CAS Name: 5-[2-(dimethylamino)-1-oxoethyl]-3-thiophenesulfonic acid IUPAC Name: 5-[2-(dimethylamino)acetyl]thiophene-3-sulfonic acid Traditional Name: 5-[2-(dimethylamino)acetyl]thiophene-3-sulfonic acid Formula: C8H11NO4S2 MolecularWeight: 249.30724

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(=O)C1=CC(=CS1)S(=O)(=O)O

Isomeric SMILES

CN(C)CC(=O)C1=CC(=CS1)S(=O)(=O)O

InChI

InChI=1S/C8H11NO4S2/c1-9(2)4-7(10)8-3-6(5-14-8)15(11,12)13/h3,5H,4H2,1-2H3,(H,11,12,13)