(2Z,4E)-5-cyano-2-methyl-1-oxidanylidene-penta-2,4-diene-1-sulfonate

Systemtic Name: (2Z,4E)-5-cyano-2-methyl-1-oxidanylidene-penta-2,4-diene-1-sulfonate Openeye Name: (2Z,4E)-5-cyano-2-methyl-1-oxo-penta-2,4-diene-1-sulfonate CAS Name: (2Z,4E)-5-cyano-2-methyl-1-oxo-1-penta-2,4-dienesulfonate IUPAC Name: (2Z,4E)-5-cyano-2-methyl-1-oxopenta-2,4-diene-1-sulfonate Traditional Name: (2Z,4E)-5-cyano-1-keto-2-methyl-penta-2,4-diene-1-sulfonate Formula: C7H6NO4S- MolecularWeight: 200.19184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=CC#N)C(=O)S(=O)(=O)[O-]

Isomeric SMILES

C/C(=C/C=C/C#N)/C(=O)S(=O)(=O)[O-]

InChI

InChI=1S/C7H7NO4S/c1-6(4-2-3-5-8)7(9)13(10,11)12/h2-4H,1H3,(H,10,11,12)/p-1/b3-2+,6-4-