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tris(2-methylpropyl)-[12-[tris(2-methylpropyl)azaniumyl]dodecyl]azanium

tris(2-methylpropyl)-[12-[tris(2-methylpropyl)azaniumyl]dodecyl]azanium

Systemtic Name:tris(2-methylpropyl)-[12-[tris(2-methylpropyl)azaniumyl]dodecyl]azanium
Openeye Name:triisobutyl-[12-(triisobutylammonio)dodecyl]ammonium
CAS Name:tris(2-methylpropyl)-[12-[tris(2-methylpropyl)ammonio]dodecyl]ammonium
IUPAC Name:tris(2-methylpropyl)-[12-[tris(2-methylpropyl)azaniumyl]dodecyl]azanium
Traditional Name:triisobutyl-[12-(triisobutylammonio)dodecyl]ammonium
Formula: C36H78N2+2
MolecularWeight: 539.01792
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+](CCCCCCCCCCCC[N+](CC(C)C)(CC(C)C)CC(C)C)(CC(C)C)CC(C)C


Isomeric SMILES

CC(C)C[N+](CCCCCCCCCCCC[N+](CC(C)C)(CC(C)C)CC(C)C)(CC(C)C)CC(C)C


InChI

InChI=1S/C36H78N2/c1-31(2)25-37(26-32(3)4,27-33(5)6)23-21-19-17-15-13-14-16-18-20-22-24-38(28-34(7)8,29-35(9)10)30-36(11)12/h31-36H,13-30H2,1-12H3/q+2


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