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disodium 5-sulfobenzene-1,3-dicarboxylate

disodium 5-sulfobenzene-1,3-dicarboxylate

Systemtic Name:disodium 5-sulfobenzene-1,3-dicarboxylate
Openeye Name:disodium 5-sulfobenzene-1,3-dicarboxylate
CAS Name:disodium 5-sulfobenzene-1,3-dicarboxylate
IUPAC Name:disodium 5-sulfobenzene-1,3-dicarboxylate
Traditional Name:disodium 5-sulfoisophthalate
Formula: C8H4Na2O7S
MolecularWeight: 290.1577
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[Na+].[Na+]


Isomeric SMILES

C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[Na+].[Na+]


InChI

InChI=1S/C8H6O7S.2Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);;/q;2*+1/p-2


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