ethyl 3-oxidanylidene-4-pyridin-1-ium-1-yl-butanoate

Systemtic Name: ethyl 3-oxidanylidene-4-pyridin-1-ium-1-yl-butanoate Openeye Name: ethyl 3-oxo-4-pyridin-1-ium-1-yl-butanoate CAS Name: 3-oxo-4-(1-pyridin-1-iumyl)butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-4-pyridin-1-ium-1-ylbutanoate Traditional Name: 3-keto-4-pyridin-1-ium-1-yl-butyric acid ethyl ester Formula: C11H14NO3+ MolecularWeight: 208.23376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14NO3/c1-2-15-11(14)8-10(13)9-12-6-4-3-5-7-12/h3-7H,2,8-9H2,1H3/q+1