ethyl (Z)-3-ethoxy-3-oxidanyl-2-pyridin-1-ium-1-yl-prop-2-enoate

Systemtic Name: ethyl (Z)-3-ethoxy-3-oxidanyl-2-pyridin-1-ium-1-yl-prop-2-enoate Openeye Name: ethyl (Z)-3-ethoxy-3-hydroxy-2-pyridin-1-ium-1-yl-prop-2-enoate CAS Name: (Z)-3-ethoxy-3-hydroxy-2-(1-pyridin-1-iumyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-ethoxy-3-hydroxy-2-pyridin-1-ium-1-ylprop-2-enoate Traditional Name: (Z)-3-ethoxy-3-hydroxy-2-pyridin-1-ium-1-yl-acrylic acid ethyl ester Formula: C12H16NO4+ MolecularWeight: 238.25974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCO/C(=C(/C(=O)OCC)\[N+]1=CC=CC=C1)/O

InChI

InChI=1S/C12H15NO4/c1-3-16-11(14)10(12(15)17-4-2)13-8-6-5-7-9-13/h5-9H,3-4H2,1-2H3/p+1