bis(5-methyl-2-propan-2-yl-cyclohexyl)-octadecyl-(3-triethoxysilylpropyl)azanium chloride

Systemtic Name: bis(5-methyl-2-propan-2-yl-cyclohexyl)-octadecyl-(3-triethoxysilylpropyl)azanium chloride Openeye Name: bis(2-isopropyl-5-methyl-cyclohexyl)-octadecyl-(3-triethoxysilylpropyl)ammonium chloride CAS Name: bis(5-methyl-2-propan-2-ylcyclohexyl)-octadecyl-(3-triethoxysilylpropyl)ammonium chloride IUPAC Name: bis(5-methyl-2-propan-2-ylcyclohexyl)-octadecyl-(3-triethoxysilylpropyl)azanium chloride Traditional Name: bis(2-isopropyl-5-methyl-cyclohexyl)-stearyl-(3-triethoxysilylpropyl)ammonium chloride Formula: C47H96ClNO3Si MolecularWeight: 786.80854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CCC[Si](OCC)(OCC)OCC)(C1CC(CCC1C(C)C)C)C2CC(CCC2C(C)C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CCC[Si](OCC)(OCC)OCC)(C1CC(CCC1C(C)C)C)C2CC(CCC2C(C)C)C.[Cl-]

InChI

InChI=1S/C47H96NO3Si.ClH/c1-11-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-35-48(46-38-42(9)31-33-44(46)40(5)6,47-39-43(10)32-34-45(47)41(7)8)36-30-37-52(49-12-2,50-13-3)51-14-4;/h40-47H,11-39H2,1-10H3;1H/q+1;/p-1