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

Systemtic Name: 5-[4-(8-phenyloctyl)phenyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[4-(8-phenyloctyl)phenyl]-2H-tetrazole CAS Name: 5-[4-(8-phenyloctyl)phenyl]-2H-tetrazole IUPAC Name: 5-[4-(8-phenyloctyl)phenyl]-2H-tetrazole Traditional Name: 5-[4-(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=C(C=C2)C3=NNN=N3

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCC2=CC=C(C=C2)C3=NNN=N3

InChI

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