(E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-3-oxidanyl-but-2-enenitrile

Systemtic Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-3-oxidanyl-but-2-enenitrile Openeye Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-3-hydroxy-but-2-enenitrile CAS Name: (E)-2-(3,5-dimethyl-1-pyridin-1-iumyl)-3-hydroxy-2-butenenitrile IUPAC Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-3-hydroxybut-2-enenitrile Traditional Name: (E)-2-(3,5-dimethylpyridin-1-ium-1-yl)-3-hydroxy-but-2-enenitrile Formula: C11H13N2O+ MolecularWeight: 189.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C(=C(C)O)C#N)C

Isomeric SMILES

CC1=CC(=C[N+](=C1)/C(=C(\C)/O)/C#N)C

InChI

InChI=1S/C11H12N2O/c1-8-4-9(2)7-13(6-8)11(5-12)10(3)14/h4,6-7H,1-3H3/p+1/b11-10+