2-[1-ethyl-2,4,5-tris(oxidanylidene)-3-(pyridin-4-ylmethyl)imidazolidin-1-ium-1-yl]ethanoate

Systemtic Name: 2-[1-ethyl-2,4,5-tris(oxidanylidene)-3-(pyridin-4-ylmethyl)imidazolidin-1-ium-1-yl]ethanoate Openeye Name: 2-[1-ethyl-2,4,5-trioxo-3-(4-pyridylmethyl)imidazolidin-1-ium-1-yl]acetate CAS Name: 2-[1-ethyl-2,4,5-trioxo-3-(pyridin-4-ylmethyl)-1-imidazolidin-1-iumyl]acetate IUPAC Name: 2-[1-ethyl-2,4,5-trioxo-3-(pyridin-4-ylmethyl)imidazolidin-1-ium-1-yl]acetate Traditional Name: 2-[1-ethyl-2,4,5-triketo-3-(4-pyridylmethyl)imidazolidin-1-ium-1-yl]acetate Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=O)C(=O)N(C1=O)CC2=CC=NC=C2)CC(=O)[O-]

Isomeric SMILES

CC[N+]1(C(=O)C(=O)N(C1=O)CC2=CC=NC=C2)CC(=O)[O-]

InChI

InChI=1S/C13H13N3O5/c1-2-16(8-10(17)18)12(20)11(19)15(13(16)21)7-9-3-5-14-6-4-9/h3-6H,2,7-8H2,1H3