2-cyano-2-[(2-cyano-1-sulfo-propan-2-yl)diazenyl]propane-1-sulfonic acid

Systemtic Name: 2-cyano-2-[(2-cyano-1-sulfo-propan-2-yl)diazenyl]propane-1-sulfonic acid Openeye Name: 2-cyano-2-(1-cyano-1-methyl-2-sulfo-ethyl)azo-propane-1-sulfonic acid CAS Name: 2-cyano-2-(2-cyano-1-sulfopropan-2-yl)azo-1-propanesulfonic acid IUPAC Name: 2-cyano-2-[(2-cyano-1-sulfopropan-2-yl)diazenyl]propane-1-sulfonic acid Traditional Name: 2-cyano-2-(1-cyano-1-methyl-2-sulfo-ethyl)azo-propane-1-sulfonic acid Formula: C8H12N4O6S2 MolecularWeight: 324.33408

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)O)(C#N)N=NC(C)(CS(=O)(=O)O)C#N

Isomeric SMILES

CC(CS(=O)(=O)O)(C#N)N=NC(C)(CS(=O)(=O)O)C#N

InChI

InChI=1S/C8H12N4O6S2/c1-7(3-9,5-19(13,14)15)11-12-8(2,4-10)6-20(16,17)18/h5-6H2,1-2H3,(H,13,14,15)(H,16,17,18)