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21-(benzotriazol-1-yl)hentetracontan-21-amine

21-(benzotriazol-1-yl)hentetracontan-21-amine

Systemtic Name:21-(benzotriazol-1-yl)hentetracontan-21-amine
Openeye Name:21-(benzotriazol-1-yl)hentetracontan-21-amine
CAS Name:21-(1-benzotriazolyl)-21-hentetracontanamine
IUPAC Name:21-(benzotriazol-1-yl)hentetracontan-21-amine
Traditional Name:[1-arachyl-1-(benzotriazol-1-yl)heneicosyl]amine
Formula: C47H88N4
MolecularWeight: 709.22842
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCCCC)(N)N1C2=CC=CC=C2N=N1


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCCCC)(N)N1C2=CC=CC=C2N=N1


InChI

InChI=1S/C47H88N4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-43-47(48,51-46-42-38-37-41-45(46)49-50-51)44-40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37-38,41-42H,3-36,39-40,43-44,48H2,1-2H3


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