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heptadecyl-bis(2-hydroxyethyl)-(phenylmethyl)azanium chloride

heptadecyl-bis(2-hydroxyethyl)-(phenylmethyl)azanium chloride

Systemtic Name:heptadecyl-bis(2-hydroxyethyl)-(phenylmethyl)azanium chloride
Openeye Name:benzyl-heptadecyl-bis(2-hydroxyethyl)ammonium chloride
CAS Name:heptadecyl-bis(2-hydroxyethyl)-(phenylmethyl)ammonium chloride
IUPAC Name:benzyl-heptadecyl-bis(2-hydroxyethyl)azanium chloride
Traditional Name:benzyl-heptadecyl-bis(2-hydroxyethyl)ammonium chloride
Formula: C28H52ClNO2
MolecularWeight: 470.17098
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C28H52NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-29(23-25-30,24-26-31)27-28-20-17-16-18-21-28;/h16-18,20-21,30-31H,2-15,19,22-27H2,1H3;1H/q+1;/p-1


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