5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-2H-benzotriazole

Systemtic Name: 5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-2H-benzotriazole Openeye Name: 5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-2H-benzotriazole CAS Name: 5-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethoxy]-2H-benzotriazole IUPAC Name: 5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-2H-benzotriazole Traditional Name: 5-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethoxy]-2H-benzotriazole Formula: C19H20F3N5O MolecularWeight: 391.39021

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC3=NNN=C3C=C2)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCOC2=CC3=NNN=C3C=C2)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C19H20F3N5O/c20-19(21,22)14-2-1-3-15(12-14)27-8-6-26(7-9-27)10-11-28-16-4-5-17-18(13-16)24-25-23-17/h1-5,12-13H,6-11H2,(H,23,24,25)