dioctadecyl-di(propan-2-yl)azanium chloride

Systemtic Name: dioctadecyl-di(propan-2-yl)azanium chloride Openeye Name: diisopropyl(dioctadecyl)ammonium chloride CAS Name: dioctadecyl-di(propan-2-yl)ammonium chloride IUPAC Name: dioctadecyl-di(propan-2-yl)azanium chloride Traditional Name: diisopropyl(distearyl)ammonium chloride Formula: C42H88ClN MolecularWeight: 642.60782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(C(C)C)C(C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(C(C)C)C(C)C.[Cl-]

InChI

InChI=1S/C42H88N.ClH/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-43(41(3)4,42(5)6)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;/h41-42H,7-40H2,1-6H3;1H/q+1;/p-1