3-(3-oxidanylbut-1-ynoxy)propane-1-sulfonic acid

Systemtic Name: 3-(3-oxidanylbut-1-ynoxy)propane-1-sulfonic acid Openeye Name: 3-(3-hydroxybut-1-ynoxy)propane-1-sulfonic acid CAS Name: 3-(3-hydroxybut-1-ynoxy)-1-propanesulfonic acid IUPAC Name: 3-(3-hydroxybut-1-ynoxy)propane-1-sulfonic acid Traditional Name: 3-(3-hydroxybut-1-ynoxy)propane-1-sulfonic acid Formula: C7H12O5S MolecularWeight: 208.23218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#COCCCS(=O)(=O)O)O

Isomeric SMILES

CC(C#COCCCS(=O)(=O)O)O

InChI

InChI=1S/C7H12O5S/c1-7(8)3-5-12-4-2-6-13(9,10)11/h7-8H,2,4,6H2,1H3,(H,9,10,11)