disodium 4,5-bis(2-hydroxyethyloxy)benzene-1,3-disulfonate

Systemtic Name: disodium 4,5-bis(2-hydroxyethyloxy)benzene-1,3-disulfonate Openeye Name: disodium 4,5-bis(2-hydroxyethoxy)benzene-1,3-disulfonate CAS Name: disodium 4,5-bis(2-hydroxyethoxy)benzene-1,3-disulfonate IUPAC Name: disodium 4,5-bis(2-hydroxyethoxy)benzene-1,3-disulfonate Traditional Name: disodium 4,5-bis(2-hydroxyethoxy)benzene-1,3-disulfonate Formula: C10H12Na2O10S2 MolecularWeight: 402.30582

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)[O-])OCCO)OCCO)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)[O-])OCCO)OCCO)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C10H14O10S2.2Na/c11-1-3-19-8-5-7(21(13,14)15)6-9(22(16,17)18)10(8)20-4-2-12;;/h5-6,11-12H,1-4H2,(H,13,14,15)(H,16,17,18);;/q;2*+1/p-2