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2,3-didodecoxypropyl-(2-hydroxyethyl)-dimethyl-azanium bromide

Systemtic Name:	2,3-didodecoxypropyl-(2-hydroxyethyl)-dimethyl-azanium bromide
Openeye Name:	2,3-didodecoxypropyl-(2-hydroxyethyl)-dimethyl-ammonium bromide
CAS Name:	2,3-didodecoxypropyl-(2-hydroxyethyl)-dimethylammonium bromide
IUPAC Name:	2,3-didodecoxypropyl-(2-hydroxyethyl)-dimethylazanium bromide
Traditional Name:	2,3-dilauryloxypropyl-(2-hydroxyethyl)-dimethyl-ammonium bromide
Formula:	C₃₁H₆₆BrNO₃
MolecularWeight:	580.76464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H66NO3.BrH/c1-5-7-9-11-13-15-17-19-21-23-27-34-30-31(29-32(3,4)25-26-33)35-28-24-22-20-18-16-14-12-10-8-6-2;/h31,33H,5-30H2,1-4H3;1H/q+1;/p-1

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