1-(4-nitrophenoxy)-3-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(4-nitrophenoxy)-3-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-nitrophenoxy)-3-[4-[3-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propan-2-ol CAS Name: 1-(4-nitrophenoxy)-3-[4-[3-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-nitrophenoxy)-3-[4-[3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-2-ol Traditional Name: 1-(4-nitrophenoxy)-3-[4-[3-(trifluoromethyl)-2-pyridyl]piperazino]propan-2-ol Formula: C19H21F3N4O4 MolecularWeight: 426.38965

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=C(C=CC=N3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=C(C=CC=N3)C(F)(F)F

InChI

InChI=1S/C19H21F3N4O4/c20-19(21,22)17-2-1-7-23-18(17)25-10-8-24(9-11-25)12-15(27)13-30-16-5-3-14(4-6-16)26(28)29/h1-7,15,27H,8-13H2