(4E)-3-cyano-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylidene)furan-2-olate

Systemtic Name: (4E)-3-cyano-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylidene)furan-2-olate Openeye Name: (4E)-3-cyano-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylene)furan-2-olate CAS Name: (4E)-3-cyano-5,5-dimethyl-4-(1-pyridin-1-iumylmethylidene)-2-furanolate IUPAC Name: (4E)-3-cyano-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylidene)furan-2-olate Traditional Name: (4E)-3-cyano-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylene)furan-2-olate Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C[N+]2=CC=CC=C2)C(=C(O1)[O-])C#N)C

Isomeric SMILES

CC1(/C(=C/[N+]2=CC=CC=C2)/C(=C(O1)[O-])C#N)C

InChI

InChI=1S/C13H12N2O2/c1-13(2)11(10(8-14)12(16)17-13)9-15-6-4-3-5-7-15/h3-7,9H,1-2H3/b11-9+