ethanoic acid; 1-[6-(furan-2-ylmethoxy)-5-(trifluoromethyl)pyridin-2-yl]piperazine

Systemtic Name: ethanoic acid; 1-[6-(furan-2-ylmethoxy)-5-(trifluoromethyl)pyridin-2-yl]piperazine Openeye Name: acetic acid; 1-[6-(2-furylmethoxy)-5-(trifluoromethyl)-2-pyridyl]piperazine CAS Name: acetic acid; 1-[6-(2-furanylmethoxy)-5-(trifluoromethyl)-2-pyridinyl]piperazine IUPAC Name: acetic acid; 1-[6-(furan-2-ylmethoxy)-5-(trifluoromethyl)pyridin-2-yl]piperazine Traditional Name: acetic acid; 1-[6-(2-furfuryloxy)-5-(trifluoromethyl)-2-pyridyl]piperazine Formula: C17H20F3N3O4 MolecularWeight: 387.35361

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CN(CCN1)C2=NC(=C(C=C2)C(F)(F)F)OCC3=CC=CO3

Isomeric SMILES

CC(=O)O.C1CN(CCN1)C2=NC(=C(C=C2)C(F)(F)F)OCC3=CC=CO3

InChI

InChI=1S/C15H16F3N3O2.C2H4O2/c16-15(17,18)12-3-4-13(21-7-5-19-6-8-21)20-14(12)23-10-11-2-1-9-22-11;1-2(3)4/h1-4,9,19H,5-8,10H2;1H3,(H,3,4)