2-[5-chloranyl-2-(2H-1,2,3,4-tetrazol-5-yloxy)phenoxy]-1-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]ethanone

Systemtic Name: 2-[5-chloranyl-2-(2H-1,2,3,4-tetrazol-5-yloxy)phenoxy]-1-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]ethanone Openeye Name: 2-[5-chloro-2-(2H-tetrazol-5-yloxy)phenoxy]-1-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]ethanone CAS Name: 2-[5-chloro-2-(2H-tetrazol-5-yloxy)phenoxy]-1-[4-[(4-fluorophenyl)methyl]-2-methyl-1-piperazinyl]ethanone IUPAC Name: 2-[5-chloro-2-(2H-tetrazol-5-yloxy)phenoxy]-1-[4-[(4-fluorophenyl)methyl]-2-methylpiperazin-1-yl]ethanone Traditional Name: 2-[5-chloro-2-(2H-tetrazol-5-yloxy)phenoxy]-1-[4-(4-fluorobenzyl)-2-methyl-piperazino]ethanone Formula: C21H22ClFN6O3 MolecularWeight: 460.889183

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)COC2=C(C=CC(=C2)Cl)OC3=NNN=N3)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1CN(CCN1C(=O)COC2=C(C=CC(=C2)Cl)OC3=NNN=N3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22ClFN6O3/c1-14-11-28(12-15-2-5-17(23)6-3-15)8-9-29(14)20(30)13-31-19-10-16(22)4-7-18(19)32-21-24-26-27-25-21/h2-7,10,14H,8-9,11-13H2,1H3,(H,24,25,26,27)