trimethyl-[2-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]oxyethyl]azanium iodide

Systemtic Name: trimethyl-[2-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]oxyethyl]azanium iodide Openeye Name: 2-(2-benzyl-5-methyl-pyrazol-3-yl)oxyethyl-trimethyl-ammonium iodide CAS Name: trimethyl-[2-[[5-methyl-2-(phenylmethyl)-3-pyrazolyl]oxy]ethyl]ammonium iodide IUPAC Name: 2-(2-benzyl-5-methylpyrazol-3-yl)oxyethyl-trimethylazanium iodide Traditional Name: 2-(2-benzyl-5-methyl-pyrazol-3-yl)oxyethyl-trimethyl-ammonium iodide Formula: C16H24IN3O MolecularWeight: 401.28573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OCC[N+](C)(C)C)CC2=CC=CC=C2.[I-]

Isomeric SMILES

CC1=NN(C(=C1)OCC[N+](C)(C)C)CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C16H24N3O.HI/c1-14-12-16(20-11-10-19(2,3)4)18(17-14)13-15-8-6-5-7-9-15;/h5-9,12H,10-11,13H2,1-4H3;1H/q+1;/p-1