ethyl 2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanoate

Systemtic Name: ethyl 2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanoate Openeye Name: ethyl 2-[4-(4-pyridyl)pyridin-1-ium-1-yl]acetate CAS Name: 2-(4-pyridin-4-yl-1-pyridin-1-iumyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-pyridin-4-ylpyridin-1-ium-1-yl)acetate Traditional Name: 2-[4-(4-pyridyl)pyridin-1-ium-1-yl]acetic acid ethyl ester Formula: C14H15N2O2+ MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CC=C(C=C1)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C[N+]1=CC=C(C=C1)C2=CC=NC=C2

InChI

InChI=1S/C14H15N2O2/c1-2-18-14(17)11-16-9-5-13(6-10-16)12-3-7-15-8-4-12/h3-10H,2,11H2,1H3/q+1