tridodecyl(1,2,3-triazin-4-yl)azanium

Systemtic Name: tridodecyl(1,2,3-triazin-4-yl)azanium Openeye Name: tridodecyl(triazin-4-yl)ammonium CAS Name: tridodecyl(4-triazinyl)ammonium IUPAC Name: tridodecyl(triazin-4-yl)azanium Traditional Name: trilauryl(triazin-4-yl)ammonium Formula: C39H77N4+ MolecularWeight: 602.05548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)C1=NN=NC=C1

Isomeric SMILES

CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)C1=NN=NC=C1

InChI

InChI=1S/C39H77N4/c1-4-7-10-13-16-19-22-25-28-31-36-43(39-34-35-40-42-41-39,37-32-29-26-23-20-17-14-11-8-5-2)38-33-30-27-24-21-18-15-12-9-6-3/h34-35H,4-33,36-38H2,1-3H3/q+1