13-dodecylpentacosan-13-yl-bis(phenylmethyl)azanium chloride

Systemtic Name: 13-dodecylpentacosan-13-yl-bis(phenylmethyl)azanium chloride Openeye Name: dibenzyl(1,1-didodecyltridecyl)ammonium chloride CAS Name: 13-dodecylpentacosan-13-yl-bis(phenylmethyl)ammonium chloride IUPAC Name: dibenzyl(13-dodecylpentacosan-13-yl)azanium chloride Traditional Name: dibenzyl(1,1-dilauryltridecyl)ammonium chloride Formula: C51H90ClN MolecularWeight: 752.72

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)[NH+](CC1=CC=CC=C1)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)[NH+](CC1=CC=CC=C1)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C51H89N.ClH/c1-4-7-10-13-16-19-22-25-28-37-44-51(45-38-29-26-23-20-17-14-11-8-5-2,46-39-30-27-24-21-18-15-12-9-6-3)52(47-49-40-33-31-34-41-49)48-50-42-35-32-36-43-50;/h31-36,40-43H,4-30,37-39,44-48H2,1-3H3;1H