3-[4-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid

Systemtic Name: 3-[4-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid Openeye Name: 3-[4-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid CAS Name: 3-[4-(3-sulfopropoxy)phenoxy]-1-propanesulfonic acid IUPAC Name: 3-[4-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid Traditional Name: 3-[4-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid Formula: C12H18O8S2 MolecularWeight: 354.39652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCS(=O)(=O)O)OCCCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1OCCCS(=O)(=O)O)OCCCS(=O)(=O)O

InChI

InChI=1S/C12H18O8S2/c13-21(14,15)9-1-7-19-11-3-5-12(6-4-11)20-8-2-10-22(16,17)18/h3-6H,1-2,7-10H2,(H,13,14,15)(H,16,17,18)