ethyl 2-(1-ethyl-4,6-dimethyl-pyrimidin-1-ium-2-yl)ethanoate iodide

Systemtic Name: ethyl 2-(1-ethyl-4,6-dimethyl-pyrimidin-1-ium-2-yl)ethanoate iodide Openeye Name: ethyl 2-(1-ethyl-4,6-dimethyl-pyrimidin-1-ium-2-yl)acetate iodide CAS Name: 2-(1-ethyl-4,6-dimethyl-2-pyrimidin-1-iumyl)acetic acid ethyl ester iodide IUPAC Name: ethyl 2-(1-ethyl-4,6-dimethylpyrimidin-1-ium-2-yl)acetate iodide Traditional Name: 2-(1-ethyl-4,6-dimethyl-pyrimidin-1-ium-2-yl)acetic acid ethyl ester iodide Formula: C12H19IN2O2 MolecularWeight: 350.19593

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=C(N=C1CC(=O)OCC)C)C.[I-]

Isomeric SMILES

CC[N+]1=C(C=C(N=C1CC(=O)OCC)C)C.[I-]

InChI

InChI=1S/C12H19N2O2.HI/c1-5-14-10(4)7-9(3)13-11(14)8-12(15)16-6-2;/h7H,5-6,8H2,1-4H3;1H/q+1;/p-1