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docosyl-dimethyl-(phenylmethyl)azanium

docosyl-dimethyl-(phenylmethyl)azanium

Systemtic Name:docosyl-dimethyl-(phenylmethyl)azanium
Openeye Name:benzyl-docosyl-dimethyl-ammonium
CAS Name:docosyl-dimethyl-(phenylmethyl)ammonium
IUPAC Name:benzyl-docosyl-dimethylazanium
Traditional Name:behenyl-benzyl-dimethyl-ammonium
Formula: C31H58N+
MolecularWeight: 444.79892
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1


InChI

InChI=1S/C31H58N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-32(2,3)30-31-27-24-23-25-28-31/h23-25,27-28H,4-22,26,29-30H2,1-3H3/q+1


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