5-tert-butylthiophene-2-sulfonic acid; sodium

Systemtic Name: 5-tert-butylthiophene-2-sulfonic acid; sodium Openeye Name: 5-tert-butylthiophene-2-sulfonic acid; sodium CAS Name: 5-tert-butyl-2-thiophenesulfonic acid; sodium IUPAC Name: 5-tert-butylthiophene-2-sulfonic acid; sodium Traditional Name: 5-tert-butylthiophene-2-sulfonic acid; sodium Formula: C8H12NaO3S2 MolecularWeight: 243.29885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(S1)S(=O)(=O)O.[Na]

Isomeric SMILES

CC(C)(C)C1=CC=C(S1)S(=O)(=O)O.[Na]

InChI

InChI=1S/C8H12O3S2.Na/c1-8(2,3)6-4-5-7(12-6)13(9,10)11;/h4-5H,1-3H3,(H,9,10,11);