2-(benzotriazol-1-yl)-1-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-[4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[4-[3-(trifluoromethyl)benzoyl]piperazino]ethanone Formula: C20H18F3N5O2 MolecularWeight: 417.38443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=CC=CC=C3N=N2)C(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=CC=CC=C3N=N2)C(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H18F3N5O2/c21-20(22,23)15-5-3-4-14(12-15)19(30)27-10-8-26(9-11-27)18(29)13-28-17-7-2-1-6-16(17)24-25-28/h1-7,12H,8-11,13H2