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4-sulfobenzene-1,3-dicarboxylic acid

4-sulfobenzene-1,3-dicarboxylic acid

Systemtic Name:4-sulfobenzene-1,3-dicarboxylic acid
Openeye Name:4-sulfobenzene-1,3-dicarboxylic acid
CAS Name:4-sulfobenzene-1,3-dicarboxylic acid
IUPAC Name:4-sulfobenzene-1,3-dicarboxylic acid
Traditional Name:4-sulfoisophthalic acid
Formula: C8H6O7S
MolecularWeight: 246.19404
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)C(=O)O)S(=O)(=O)O


Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)C(=O)O)S(=O)(=O)O


InChI

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


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