3,4-bis(2-hydroxyethyloxycarbonyl)benzenesulfonate

Systemtic Name: 3,4-bis(2-hydroxyethyloxycarbonyl)benzenesulfonate Openeye Name: 3,4-bis(2-hydroxyethoxycarbonyl)benzenesulfonate CAS Name: 3,4-bis[2-hydroxyethoxy(oxo)methyl]benzenesulfonate IUPAC Name: 3,4-bis(2-hydroxyethoxycarbonyl)benzenesulfonate Traditional Name: 3,4-bis(2-hydroxyethoxycarbonyl)besylate Formula: C12H13O9S- MolecularWeight: 333.29122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)OCCO)C(=O)OCCO

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)OCCO)C(=O)OCCO

InChI

InChI=1S/C12H14O9S/c13-3-5-20-11(15)9-2-1-8(22(17,18)19)7-10(9)12(16)21-6-4-14/h1-2,7,13-14H,3-6H2,(H,17,18,19)/p-1