ethanedioic acid; N-(pyrrolidin-2-ylmethyl)-3-(trifluoromethyl)aniline

Systemtic Name: ethanedioic acid; N-(pyrrolidin-2-ylmethyl)-3-(trifluoromethyl)aniline Openeye Name: oxalic acid; N-(pyrrolidin-2-ylmethyl)-3-(trifluoromethyl)aniline CAS Name: oxalic acid; N-(2-pyrrolidinylmethyl)-3-(trifluoromethyl)aniline IUPAC Name: oxalic acid; N-(pyrrolidin-2-ylmethyl)-3-(trifluoromethyl)aniline Traditional Name: oxalic acid; pyrrolidin-2-ylmethyl-[3-(trifluoromethyl)phenyl]amine Formula: C16H19F3N2O8 MolecularWeight: 424.32587

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)CNC2=CC=CC(=C2)C(F)(F)F.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(NC1)CNC2=CC=CC(=C2)C(F)(F)F.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H15F3N2.2C2H2O4/c13-12(14,15)9-3-1-4-10(7-9)17-8-11-5-2-6-16-11;2*3-1(4)2(5)6/h1,3-4,7,11,16-17H,2,5-6,8H2;2*(H,3,4)(H,5,6)