ethanedioic acid; 3-(furan-3-yl)-1-[3-(trifluoromethyl)phenoxy]propan-1-amine

Systemtic Name: ethanedioic acid; 3-(furan-3-yl)-1-[3-(trifluoromethyl)phenoxy]propan-1-amine Openeye Name: 3-(3-furyl)-1-[3-(trifluoromethyl)phenoxy]propan-1-amine; oxalic acid CAS Name: 3-(3-furanyl)-1-[3-(trifluoromethyl)phenoxy]-1-propanamine; oxalic acid IUPAC Name: 3-(furan-3-yl)-1-[3-(trifluoromethyl)phenoxy]propan-1-amine; oxalic acid Traditional Name: [3-(3-furyl)-1-[3-(trifluoromethyl)phenoxy]propyl]amine; oxalic acid Formula: C16H16F3NO6 MolecularWeight: 375.29655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(CCC2=COC=C2)N)C(F)(F)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)OC(CCC2=COC=C2)N)C(F)(F)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H14F3NO2.C2H2O4/c15-14(16,17)11-2-1-3-12(8-11)20-13(18)5-4-10-6-7-19-9-10;3-1(4)2(5)6/h1-3,6-9,13H,4-5,18H2;(H,3,4)(H,5,6)