diethyl-methyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxy-piperidin-1-ium-3-yl)methyl]azanium diiodide

Systemtic Name: diethyl-methyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxy-piperidin-1-ium-3-yl)methyl]azanium diiodide Openeye Name: diethyl-methyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxy-piperidin-1-ium-3-yl)methyl]ammonium diiodide CAS Name: diethyl-methyl-[[1,1,3,6-tetramethyl-4-(1-oxopropoxy)-4-phenyl-3-piperidin-1-iumyl]methyl]ammonium diiodide IUPAC Name: diethyl-methyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxypiperidin-1-ium-3-yl)methyl]azanium diiodide Traditional Name: diethyl-methyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propionyloxy-piperidin-1-ium-3-yl)methyl]ammonium diiodide Formula: C24H42I2N2O2 MolecularWeight: 644.41142

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(CC([N+](CC1(C)C[N+](C)(CC)CC)(C)C)C)C2=CC=CC=C2.[I-].[I-]

Isomeric SMILES

CCC(=O)OC1(CC([N+](CC1(C)C[N+](C)(CC)CC)(C)C)C)C2=CC=CC=C2.[I-].[I-]

InChI

InChI=1S/C24H42N2O2.2HI/c1-9-22(27)28-24(21-15-13-12-14-16-21)17-20(4)25(6,7)18-23(24,5)19-26(8,10-2)11-3;;/h12-16,20H,9-11,17-19H2,1-8H3;2*1H/q+2;;/p-2