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tridodecyl-(phenylmethyl)azanium

tridodecyl-(phenylmethyl)azanium

Systemtic Name:tridodecyl-(phenylmethyl)azanium
Openeye Name:benzyl(tridodecyl)ammonium
CAS Name:tridodecyl-(phenylmethyl)ammonium
IUPAC Name:benzyl(tridodecyl)azanium
Traditional Name:benzyl(trilauryl)ammonium
Formula: C43H82N+
MolecularWeight: 613.11788
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)CC1=CC=CC=C1


Isomeric SMILES

CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)CC1=CC=CC=C1


InChI

InChI=1S/C43H82N/c1-4-7-10-13-16-19-22-25-28-34-39-44(42-43-37-32-31-33-38-43,40-35-29-26-23-20-17-14-11-8-5-2)41-36-30-27-24-21-18-15-12-9-6-3/h31-33,37-38H,4-30,34-36,39-42H2,1-3H3/q+1


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