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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC(=C1)OC(CCN)C2=COC=C2)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(4-6-18)10-5-7-19-9-10;3-1(4)2(5)6/h1-3,5,7-9,13H,4,6,18H2;(H,3,4)(H,5,6)