ethyl 1-(2-ethoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-(2-ethoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-carboxylate Openeye Name: ethyl 1-(2-ethoxy-2-oxo-ethyl)pyridin-1-ium-4-carboxylate CAS Name: 1-(2-ethoxy-2-oxoethyl)-4-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-ethoxy-2-oxoethyl)pyridin-1-ium-4-carboxylate Traditional Name: 1-(2-ethoxy-2-keto-ethyl)pyridin-1-ium-4-carboxylic acid ethyl ester Formula: C12H16NO4+ MolecularWeight: 238.25974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16NO4/c1-3-16-11(14)9-13-7-5-10(6-8-13)12(15)17-4-2/h5-8H,3-4,9H2,1-2H3/q+1