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

Systemtic Name: 5-[2-(4-phenylbutoxy)phenyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[2-(4-phenylbutoxy)phenyl]-2H-tetrazole CAS Name: 5-[2-(4-phenylbutoxy)phenyl]-2H-tetrazole IUPAC Name: 5-[2-(4-phenylbutoxy)phenyl]-2H-tetrazole Traditional Name: 5-[2-(4-phenylbutoxy)phenyl]-2H-tetrazole Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC=CC=C2C3=NNN=N3

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC=CC=C2C3=NNN=N3

InChI

InChI=1S/C17H18N4O/c1-2-8-14(9-3-1)10-6-7-13-22-16-12-5-4-11-15(16)17-18-20-21-19-17/h1-5,8-9,11-12H,6-7,10,13H2,(H,18,19,20,21)