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

Systemtic Name: diethyl-methyl-[[1,1,3,6-tetramethyl-4-phenyl-4-(phenylcarbonyloxy)piperidin-1-ium-3-yl]methyl]azanium diiodide Openeye Name: (4-benzoyloxy-1,1,3,6-tetramethyl-4-phenyl-piperidin-1-ium-3-yl)methyl-diethyl-methyl-ammonium diiodide CAS Name: (4-benzoyloxy-1,1,3,6-tetramethyl-4-phenyl-3-piperidin-1-iumyl)methyl-diethyl-methylammonium diiodide IUPAC Name: (4-benzoyloxy-1,1,3,6-tetramethyl-4-phenylpiperidin-1-ium-3-yl)methyl-diethyl-methylazanium diiodide Traditional Name: (4-benzoyloxy-1,1,3,6-tetramethyl-4-phenyl-piperidin-1-ium-3-yl)methyl-diethyl-methyl-ammonium diiodide Formula: C28H42I2N2O2 MolecularWeight: 692.45422

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC1(C[N+](C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C)(C)C)C.[I-].[I-]

Isomeric SMILES

CC[N+](C)(CC)CC1(C[N+](C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C)(C)C)C.[I-].[I-]

InChI

InChI=1S/C28H42N2O2.2HI/c1-8-30(7,9-2)22-27(4)21-29(5,6)23(3)20-28(27,25-18-14-11-15-19-25)32-26(31)24-16-12-10-13-17-24;;/h10-19,23H,8-9,20-22H2,1-7H3;2*1H/q+2;;/p-2