3-[3-(3-sulfinooxypropoxy)-5-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid

Systemtic Name: 3-[3-(3-sulfinooxypropoxy)-5-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid Openeye Name: 3-[3-(3-sulfinooxypropoxy)-5-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid CAS Name: 3-[3-(3-sulfinooxypropoxy)-5-(3-sulfopropoxy)phenoxy]-1-propanesulfonic acid IUPAC Name: 3-[3-(3-sulfinooxypropoxy)-5-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid Traditional Name: 3-[3-(3-sulfinooxypropoxy)-5-(3-sulfopropoxy)phenoxy]propane-1-sulfonic acid Formula: C15H24O12S3 MolecularWeight: 492.53886

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1OCCCS(=O)(=O)O)OCCCS(=O)(=O)O)OCCCOS(=O)O

Isomeric SMILES

C1=C(C=C(C=C1OCCCS(=O)(=O)O)OCCCS(=O)(=O)O)OCCCOS(=O)O

InChI

InChI=1S/C15H24O12S3/c16-28(17)27-7-1-4-24-13-10-14(25-5-2-8-29(18,19)20)12-15(11-13)26-6-3-9-30(21,22)23/h10-12H,1-9H2,(H,16,17)(H,18,19,20)(H,21,22,23)