1-azanylpropyl(1,1,2-tridodecoxyethyl)azanium bromide

Systemtic Name: 1-azanylpropyl(1,1,2-tridodecoxyethyl)azanium bromide Openeye Name: 1-aminopropyl(1,1,2-tridodecoxyethyl)ammonium bromide CAS Name: 1-aminopropyl(1,1,2-tridodecoxyethyl)ammonium bromide IUPAC Name: 1-aminopropyl(1,1,2-tridodecoxyethyl)azanium bromide Traditional Name: 1-aminopropyl(1,1,2-trilauryloxyethyl)ammonium bromide Formula: C41H87BrN2O3 MolecularWeight: 736.04508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC([NH2+]C(CC)N)(OCCCCCCCCCCCC)OCCCCCCCCCCCC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCOCC([NH2+]C(CC)N)(OCCCCCCCCCCCC)OCCCCCCCCCCCC.[Br-]

InChI

InChI=1S/C41H86N2O3.BrH/c1-5-9-12-15-18-21-24-27-30-33-36-44-39-41(43-40(42)8-4,45-37-34-31-28-25-22-19-16-13-10-6-2)46-38-35-32-29-26-23-20-17-14-11-7-3;/h40,43H,5-39,42H2,1-4H3;1H