sodium 2-[4-(dicyanomethylidene)-2,6-dimethyl-pyridin-1-yl]ethyl sulfate

Systemtic Name: sodium 2-[4-(dicyanomethylidene)-2,6-dimethyl-pyridin-1-yl]ethyl sulfate Openeye Name: sodium 2-[4-(dicyanomethylene)-2,6-dimethyl-1-pyridyl]ethyl sulfate CAS Name: sodium 2-[4-(dicyanomethylidene)-2,6-dimethyl-1-pyridinyl]ethyl sulfate IUPAC Name: sodium 2-[4-(dicyanomethylidene)-2,6-dimethylpyridin-1-yl]ethyl sulfate Traditional Name: sodium 2-[4-(dicyanomethylene)-2,6-dimethyl-1-pyridyl]ethyl sulfate Formula: C12H12N3NaO4S MolecularWeight: 317.29615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C#N)C#N)C=C(N1CCOS(=O)(=O)[O-])C.[Na+]

Isomeric SMILES

CC1=CC(=C(C#N)C#N)C=C(N1CCOS(=O)(=O)[O-])C.[Na+]

InChI

InChI=1S/C12H13N3O4S.Na/c1-9-5-11(12(7-13)8-14)6-10(2)15(9)3-4-19-20(16,17)18;/h5-6H,3-4H2,1-2H3,(H,16,17,18);/q;+1/p-1