1-methyl-1-[[2-(1-phenylethyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium iodide

Systemtic Name: 1-methyl-1-[[2-(1-phenylethyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium iodide Openeye Name: 1-methyl-1-[[2-(1-phenylethyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium iodide CAS Name: 1-methyl-1-[[2-(1-phenylethyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium iodide IUPAC Name: 1-methyl-1-[[2-(1-phenylethyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium iodide Traditional Name: 1-methyl-1-[[2-(1-phenylethyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium iodide Formula: C18H28INO2 MolecularWeight: 417.32489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1OCC(O1)C[N+]2(CCCCC2)C)C3=CC=CC=C3.[I-]

Isomeric SMILES

CC(C1OCC(O1)C[N+]2(CCCCC2)C)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C18H28NO2.HI/c1-15(16-9-5-3-6-10-16)18-20-14-17(21-18)13-19(2)11-7-4-8-12-19;/h3,5-6,9-10,15,17-18H,4,7-8,11-14H2,1-2H3;1H/q+1;/p-1