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3,5-bis[2-(2-oxidanylpropoxy)ethoxycarbonyl]benzenesulfonic acid

3,5-bis[2-(2-oxidanylpropoxy)ethoxycarbonyl]benzenesulfonic acid

Systemtic Name:3,5-bis[2-(2-oxidanylpropoxy)ethoxycarbonyl]benzenesulfonic acid
Openeye Name:3,5-bis[2-(2-hydroxypropoxy)ethoxycarbonyl]benzenesulfonic acid
CAS Name:3,5-bis[2-(2-hydroxypropoxy)ethoxy-oxomethyl]benzenesulfonic acid
IUPAC Name:3,5-bis[2-(2-hydroxypropoxy)ethoxycarbonyl]benzenesulfonic acid
Traditional Name:3,5-bis[2-(2-hydroxypropoxy)ethoxycarbonyl]besylic acid
Formula: C18H26O11S
MolecularWeight: 450.45744
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Descriptors Computed from Structure

Canonical SMILES:

CC(COCCOC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OCCOCC(C)O)O


Isomeric SMILES

CC(COCCOC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OCCOCC(C)O)O


InChI

InChI=1S/C18H26O11S/c1-12(19)10-26-3-5-28-17(21)14-7-15(9-16(8-14)30(23,24)25)18(22)29-6-4-27-11-13(2)20/h7-9,12-13,19-20H,3-6,10-11H2,1-2H3,(H,23,24,25)


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