pyridin-3-yl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone dihydrochloride

Systemtic Name: pyridin-3-yl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone dihydrochloride Openeye Name: 3-pyridyl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone dihydrochloride CAS Name: 3-pyridinyl-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone dihydrochloride IUPAC Name: pyridin-3-yl-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone dihydrochloride Traditional Name: 3-pyridyl-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone dihydrochloride Formula: C17H18Cl2F3N3O MolecularWeight: 408.24553

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CN=CC=C3.Cl.Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CN=CC=C3.Cl.Cl

InChI

InChI=1S/C17H16F3N3O.2ClH/c18-17(19,20)14-4-1-5-15(11-14)22-7-9-23(10-8-22)16(24)13-3-2-6-21-12-13;;/h1-6,11-12H,7-10H2;2*1H