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icosyl-dimethyl-(phenylmethyl)azanium chloride

icosyl-dimethyl-(phenylmethyl)azanium chloride

Systemtic Name:icosyl-dimethyl-(phenylmethyl)azanium chloride
Openeye Name:benzyl-icosyl-dimethyl-ammonium chloride
CAS Name:eicosyl-dimethyl-(phenylmethyl)ammonium chloride
IUPAC Name:benzyl-icosyl-dimethylazanium chloride
Traditional Name:arachyl-benzyl-dimethyl-ammonium chloride
Formula: C29H54ClN
MolecularWeight: 452.19876
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]


InChI

InChI=1S/C29H54N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-30(2,3)28-29-25-22-21-23-26-29;/h21-23,25-26H,4-20,24,27-28H2,1-3H3;1H/q+1;/p-1


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