(4Z)-5,5-dimethyl-2-oxidanyl-4-(pyridin-1-ium-1-ylmethylidene)furan-3-carbonitrile

Systemtic Name: (4Z)-5,5-dimethyl-2-oxidanyl-4-(pyridin-1-ium-1-ylmethylidene)furan-3-carbonitrile Openeye Name: (4Z)-2-hydroxy-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylene)furan-3-carbonitrile CAS Name: (4Z)-2-hydroxy-5,5-dimethyl-4-(1-pyridin-1-iumylmethylidene)-3-furancarbonitrile IUPAC Name: (4Z)-2-hydroxy-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylidene)furan-3-carbonitrile Traditional Name: (4Z)-2-hydroxy-5,5-dimethyl-4-(pyridin-1-ium-1-ylmethylene)-3-furonitrile Formula: C13H13N2O2+ MolecularWeight: 229.25452

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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/p+1/b11-9-