3,3-dimethyl-2H-1-benzofuran-5-sulfonic acid

Systemtic Name: 3,3-dimethyl-2H-1-benzofuran-5-sulfonic acid Openeye Name: 3,3-dimethyl-2H-benzofuran-5-sulfonic acid CAS Name: 3,3-dimethyl-2H-benzofuran-5-sulfonic acid IUPAC Name: 3,3-dimethyl-2H-1-benzofuran-5-sulfonic acid Traditional Name: 3,3-dimethylcoumaran-5-sulfonic acid Formula: C10H12O4S MolecularWeight: 228.26488

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=C(C=C2)S(=O)(=O)O)C

Isomeric SMILES

CC1(COC2=C1C=C(C=C2)S(=O)(=O)O)C

InChI

InChI=1S/C10H12O4S/c1-10(2)6-14-9-4-3-7(5-8(9)10)15(11,12)13/h3-5H,6H2,1-2H3,(H,11,12,13)