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tris(2-methyl-1-adamantyl)azanium iodide

tris(2-methyl-1-adamantyl)azanium iodide

Systemtic Name:tris(2-methyl-1-adamantyl)azanium iodide
Openeye Name:tris(2-methyl-1-adamantyl)ammonium iodide
CAS Name:tris(2-methyl-1-adamantyl)ammonium iodide
IUPAC Name:tris(2-methyl-1-adamantyl)azanium iodide
Traditional Name:tris(2-methyl-1-adamantyl)ammonium iodide
Formula: C33H52IN
MolecularWeight: 589.67715
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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC3CC(C2)CC1(C3)[NH+](C45CC6CC(C4)CC(C6)C5C)C78CC9CC(C7)CC(C9)C8C.[I-]


Isomeric SMILES

CC1C2CC3CC(C2)CC1(C3)[NH+](C45CC6CC(C4)CC(C6)C5C)C78CC9CC(C7)CC(C9)C8C.[I-]


InChI

InChI=1S/C33H51N.HI/c1-19-28-7-22-4-23(8-28)14-31(19,13-22)34(32-15-24-5-25(16-32)10-29(9-24)20(32)2)33-17-26-6-27(18-33)12-30(11-26)21(33)3;/h19-30H,4-18H2,1-3H3;1H


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