4-(1-adamantylcarbonyloxy)butyl-trimethyl-azanium iodide

Systemtic Name: 4-(1-adamantylcarbonyloxy)butyl-trimethyl-azanium iodide Openeye Name: 4-(adamantane-1-carbonyloxy)butyl-trimethyl-ammonium iodide CAS Name: 4-[1-adamantyl(oxo)methoxy]butyl-trimethylammonium iodide IUPAC Name: 4-(adamantane-1-carbonyloxy)butyl-trimethylazanium iodide Traditional Name: 4-(adamantane-1-carbonyloxy)butyl-trimethyl-ammonium iodide Formula: C18H32INO2 MolecularWeight: 421.35665

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCOC(=O)C12CC3CC(C1)CC(C3)C2.[I-]

Isomeric SMILES

C[N+](C)(C)CCCCOC(=O)C12CC3CC(C1)CC(C3)C2.[I-]

InChI

InChI=1S/C18H32NO2.HI/c1-19(2,3)6-4-5-7-21-17(20)18-11-14-8-15(12-18)10-16(9-14)13-18;/h14-16H,4-13H2,1-3H3;1H/q+1;/p-1