sodium 3-(3,4-dimethanoylphenyl)sulfonylpropane-1-sulfonate

Systemtic Name: sodium 3-(3,4-dimethanoylphenyl)sulfonylpropane-1-sulfonate Openeye Name: sodium 3-(3,4-diformylphenyl)sulfonylpropane-1-sulfonate CAS Name: sodium 3-(3,4-diformylphenyl)sulfonyl-1-propanesulfonate IUPAC Name: sodium 3-(3,4-diformylphenyl)sulfonylpropane-1-sulfonate Traditional Name: sodium 3-(3,4-diformylphenyl)sulfonylpropane-1-sulfonate Formula: C11H11NaO7S2 MolecularWeight: 342.32061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)CCCS(=O)(=O)[O-])C=O)C=O.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)CCCS(=O)(=O)[O-])C=O)C=O.[Na+]

InChI

InChI=1S/C11H12O7S2.Na/c12-7-9-2-3-11(6-10(9)8-13)19(14,15)4-1-5-20(16,17)18;/h2-3,6-8H,1,4-5H2,(H,16,17,18);/q;+1/p-1