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trimethyl-(phenylmethyl)azanium; trioctyl(propyl)azanium; dibromide

trimethyl-(phenylmethyl)azanium; trioctyl(propyl)azanium; dibromide

Systemtic Name:trimethyl-(phenylmethyl)azanium; trioctyl(propyl)azanium; dibromide
Openeye Name:benzyl(trimethyl)ammonium; trioctyl(propyl)ammonium; dibromide
CAS Name:trimethyl-(phenylmethyl)ammonium; trioctyl(propyl)ammonium; dibromide
IUPAC Name:benzyl(trimethyl)azanium; trioctyl(propyl)azanium; dibromide
Traditional Name:benzyl(trimethyl)ammonium; trioctyl(propyl)ammonium; dibromide
Formula: C37H74Br2N2
MolecularWeight: 706.80486
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCC)(CCCCCCCC)CCCCCCCC.C[N+](C)(C)CC1=CC=CC=C1.[Br-].[Br-]


Isomeric SMILES

CCCCCCCC[N+](CCC)(CCCCCCCC)CCCCCCCC.C[N+](C)(C)CC1=CC=CC=C1.[Br-].[Br-]


InChI

InChI=1S/C27H58N.C10H16N.2BrH/c1-5-9-12-15-18-21-25-28(24-8-4,26-22-19-16-13-10-6-2)27-23-20-17-14-11-7-3;1-11(2,3)9-10-7-5-4-6-8-10;;/h5-27H2,1-4H3;4-8H,9H2,1-3H3;2*1H/q2*+1;;/p-2


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