3-[4-[4-(3-sulfonatopropoxy)phenyl]sulfonylphenoxy]propane-1-sulfonate

Systemtic Name: 3-[4-[4-(3-sulfonatopropoxy)phenyl]sulfonylphenoxy]propane-1-sulfonate Openeye Name: 3-[4-[4-(3-sulfonatopropoxy)phenyl]sulfonylphenoxy]propane-1-sulfonate CAS Name: 3-[4-[4-(3-sulfonatopropoxy)phenyl]sulfonylphenoxy]-1-propanesulfonate IUPAC Name: 3-[4-[4-(3-sulfonatopropoxy)phenyl]sulfonylphenoxy]propane-1-sulfonate Traditional Name: 3-[4-[4-(3-sulfonatopropoxy)phenyl]sulfonylphenoxy]propane-1-sulfonate Formula: C18H20O10S3-2 MolecularWeight: 492.5404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCS(=O)(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)OCCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1OCCCS(=O)(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)OCCCS(=O)(=O)[O-]

InChI

InChI=1S/C18H22O10S3/c19-29(20,21)13-1-11-27-15-3-7-17(8-4-15)31(25,26)18-9-5-16(6-10-18)28-12-2-14-30(22,23)24/h3-10H,1-2,11-14H2,(H,19,20,21)(H,22,23,24)/p-2