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5-[2-(8-phenyloctyl)phenyl]-2H-1,2,3,4-tetrazole

5-[2-(8-phenyloctyl)phenyl]-2H-1,2,3,4-tetrazole

Systemtic Name:5-[2-(8-phenyloctyl)phenyl]-2H-1,2,3,4-tetrazole
Openeye Name:5-[2-(8-phenyloctyl)phenyl]-2H-tetrazole
CAS Name:5-[2-(8-phenyloctyl)phenyl]-2H-tetrazole
IUPAC Name:5-[2-(8-phenyloctyl)phenyl]-2H-tetrazole
Traditional Name:5-[2-(8-phenyloctyl)phenyl]-2H-tetrazole
Formula: C21H26N4
MolecularWeight: 334.45794
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2C3=NNN=N3


Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2C3=NNN=N3


InChI

InChI=1S/C21H26N4/c1(3-6-12-18-13-7-5-8-14-18)2-4-9-15-19-16-10-11-17-20(19)21-22-24-25-23-21/h5,7-8,10-11,13-14,16-17H,1-4,6,9,12,15H2,(H,22,23,24,25)


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