3,5-diethylpyridin-1-ium ethanoate

Systemtic Name: 3,5-diethylpyridin-1-ium ethanoate Openeye Name: 3,5-diethylpyridin-1-ium acetate CAS Name: 3,5-diethylpyridin-1-ium acetate IUPAC Name: 3,5-diethylpyridin-1-ium acetate Traditional Name: 3,5-diethylpyridin-1-ium acetate Formula: C11H17NO2 MolecularWeight: 195.25818

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C[NH+]=C1)CC.CC(=O)[O-]

Isomeric SMILES

CCC1=CC(=C[NH+]=C1)CC.CC(=O)[O-]

InChI

InChI=1S/C9H13N.C2H4O2/c1-3-8-5-9(4-2)7-10-6-8;1-2(3)4/h5-7H,3-4H2,1-2H3;1H3,(H,3,4)