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heptadecyl-dimethyl-(phenylmethyl)azanium chloride

heptadecyl-dimethyl-(phenylmethyl)azanium chloride

Systemtic Name:heptadecyl-dimethyl-(phenylmethyl)azanium chloride
Openeye Name:benzyl-heptadecyl-dimethyl-ammonium chloride
CAS Name:heptadecyl-dimethyl-(phenylmethyl)ammonium chloride
IUPAC Name:benzyl-heptadecyl-dimethylazanium chloride
Traditional Name:benzyl-heptadecyl-dimethyl-ammonium chloride
Formula: C26H48ClN
MolecularWeight: 410.11902
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C26H48N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-27(2,3)25-26-22-19-18-20-23-26;/h18-20,22-23H,4-17,21,24-25H2,1-3H3;1H/q+1;/p-1


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