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

Systemtic Name: ethanedioic acid; 3-[4-(trifluoromethyl)phenyl]pyrrolidine Openeye Name: oxalic acid; 3-[4-(trifluoromethyl)phenyl]pyrrolidine CAS Name: oxalic acid; 3-[4-(trifluoromethyl)phenyl]pyrrolidine IUPAC Name: oxalic acid; 3-[4-(trifluoromethyl)phenyl]pyrrolidine Traditional Name: oxalic acid; 3-[4-(trifluoromethyl)phenyl]pyrrolidine Formula: C13H14F3NO4 MolecularWeight: 305.24977

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=CC=C(C=C2)C(F)(F)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CNCC1C2=CC=C(C=C2)C(F)(F)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H12F3N.C2H2O4/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9;3-1(4)2(5)6/h1-4,9,15H,5-7H2;(H,3,4)(H,5,6)