N-[ethyl(propan-2-yloxy)phosphoryl]oxy-1-(1-methylpyridin-1-ium-3-yl)ethanimine iodide

Systemtic Name: N-[ethyl(propan-2-yloxy)phosphoryl]oxy-1-(1-methylpyridin-1-ium-3-yl)ethanimine iodide Openeye Name: N-[ethyl(isopropoxy)phosphoryl]oxy-1-(1-methylpyridin-1-ium-3-yl)ethanimine iodide CAS Name: N-[ethyl(propan-2-yloxy)phosphoryl]oxy-1-(1-methyl-3-pyridin-1-iumyl)ethanimine iodide IUPAC Name: N-[ethyl(propan-2-yloxy)phosphoryl]oxy-1-(1-methylpyridin-1-ium-3-yl)ethanimine iodide Traditional Name: (E)-[ethyl(isopropoxy)phosphoryl]oxy-[1-(1-methylpyridin-1-ium-3-yl)ethylidene]amine iodide Formula: C13H22IN2O3P MolecularWeight: 412.203611

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Descriptors Computed from Structure

Canonical SMILES:

CCP(=O)(OC(C)C)ON=C(C)C1=C[N+](=CC=C1)C.[I-]

Isomeric SMILES

CCP(=O)(OC(C)C)O/N=C(\C)/C1=C[N+](=CC=C1)C.[I-]

InChI

InChI=1S/C13H22N2O3P.HI/c1-6-19(16,17-11(2)3)18-14-12(4)13-8-7-9-15(5)10-13;/h7-11H,6H2,1-5H3;1H/q+1;/p-1/b14-12+;