1-oxidanyl-3-(4-oxidanylbut-2-ynoxy)propane-1-sulfonic acid

Systemtic Name: 1-oxidanyl-3-(4-oxidanylbut-2-ynoxy)propane-1-sulfonic acid Openeye Name: 1-hydroxy-3-(4-hydroxybut-2-ynoxy)propane-1-sulfonic acid CAS Name: 1-hydroxy-3-(4-hydroxybut-2-ynoxy)-1-propanesulfonic acid IUPAC Name: 1-hydroxy-3-(4-hydroxybut-2-ynoxy)propane-1-sulfonic acid Traditional Name: 1-hydroxy-3-(4-hydroxybut-2-ynoxy)propane-1-sulfonic acid Formula: C7H12O6S MolecularWeight: 224.23158

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Descriptors Computed from Structure

Canonical SMILES:

C(COCC#CCO)C(O)S(=O)(=O)O

Isomeric SMILES

C(COCC#CCO)C(O)S(=O)(=O)O

InChI

InChI=1S/C7H12O6S/c8-4-1-2-5-13-6-3-7(9)14(10,11)12/h7-9H,3-6H2,(H,10,11,12)