ethanedioic acid; 3-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine

Systemtic Name: ethanedioic acid; 3-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine Openeye Name: oxalic acid; 3-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine CAS Name: oxalic acid; 3-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine IUPAC Name: oxalic acid; 3-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine Traditional Name: oxalic acid; 3-[4-(trifluoromethyl)benzyl]pyrrolidine Formula: C14H16F3NO4 MolecularWeight: 319.27635

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1CC2=CC=C(C=C2)C(F)(F)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CNCC1CC2=CC=C(C=C2)C(F)(F)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H14F3N.C2H2O4/c13-12(14,15)11-3-1-9(2-4-11)7-10-5-6-16-8-10;3-1(4)2(5)6/h1-4,10,16H,5-8H2;(H,3,4)(H,5,6)