5-[2-(3-cyclopentyloxy-4-methoxy-phenyl)-4-phenyl-but-3-ynyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[2-(3-cyclopentyloxy-4-methoxy-phenyl)-4-phenyl-but-3-ynyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[2-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-phenyl-but-3-ynyl]-2H-tetrazole CAS Name: 5-[2-(3-cyclopentyloxy-4-methoxyphenyl)-4-phenylbut-3-ynyl]-2H-tetrazole IUPAC Name: 5-[2-(3-cyclopentyloxy-4-methoxyphenyl)-4-phenylbut-3-ynyl]-2H-tetrazole Traditional Name: 5-[2-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-phenyl-but-3-ynyl]-2H-tetrazole Formula: C23H24N4O2 MolecularWeight: 388.46226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2=NNN=N2)C#CC3=CC=CC=C3)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC2=NNN=N2)C#CC3=CC=CC=C3)OC4CCCC4

InChI

InChI=1S/C23H24N4O2/c1-28-21-14-13-18(15-22(21)29-20-9-5-6-10-20)19(16-23-24-26-27-25-23)12-11-17-7-3-2-4-8-17/h2-4,7-8,13-15,19-20H,5-6,9-10,16H2,1H3,(H,24,25,26,27)