1-[2-(aminomethyl)-1-[3-(trifluoromethyl)phenyl]carbonyl-piperidin-2-yl]-2-azanyl-ethanone

Systemtic Name: 1-[2-(aminomethyl)-1-[3-(trifluoromethyl)phenyl]carbonyl-piperidin-2-yl]-2-azanyl-ethanone Openeye Name: 2-amino-1-[2-(aminomethyl)-1-[3-(trifluoromethyl)benzoyl]-2-piperidyl]ethanone CAS Name: 2-amino-1-[2-(aminomethyl)-1-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-piperidinyl]ethanone IUPAC Name: 2-amino-1-[2-(aminomethyl)-1-[3-(trifluoromethyl)benzoyl]piperidin-2-yl]ethanone Traditional Name: 2-amino-1-[2-(aminomethyl)-1-[3-(trifluoromethyl)benzoyl]-2-piperidyl]ethanone Formula: C16H20F3N3O2 MolecularWeight: 343.34411

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)(CN)C(=O)CN)C(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1CCN(C(C1)(CN)C(=O)CN)C(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C16H20F3N3O2/c17-16(18,19)12-5-3-4-11(8-12)14(24)22-7-2-1-6-15(22,10-21)13(23)9-20/h3-5,8H,1-2,6-7,9-10,20-21H2