3-(1,3-benzodioxol-5-yloxy)propane-1-sulfonic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yloxy)propane-1-sulfonic acid Openeye Name: 3-(1,3-benzodioxol-5-yloxy)propane-1-sulfonic acid CAS Name: 3-(1,3-benzodioxol-5-yloxy)-1-propanesulfonic acid IUPAC Name: 3-(1,3-benzodioxol-5-yloxy)propane-1-sulfonic acid Traditional Name: 3-(1,3-benzodioxol-5-yloxy)propane-1-sulfonic acid Formula: C10H12O6S MolecularWeight: 260.26368

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCCCS(=O)(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCCCS(=O)(=O)O

InChI

InChI=1S/C10H12O6S/c11-17(12,13)5-1-4-14-8-2-3-9-10(6-8)16-7-15-9/h2-3,6H,1,4-5,7H2,(H,11,12,13)