ethanedioic acid; 4-[(2-fluorophenyl)methylidene]-1-[2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl]piperidine

Systemtic Name: ethanedioic acid; 4-[(2-fluorophenyl)methylidene]-1-[2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl]piperidine Openeye Name: 4-[(2-fluorophenyl)methylene]-1-[2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl]piperidine; oxalic acid CAS Name: 4-[(2-fluorophenyl)methylidene]-1-[2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl]piperidine; oxalic acid IUPAC Name: 4-[(2-fluorophenyl)methylidene]-1-[2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl]piperidine; oxalic acid Traditional Name: 4-(2-fluorobenzylidene)-1-[2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl]piperidine; oxalic acid Formula: C25H25F2N3O4 MolecularWeight: 469.480506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=CC2=CC=CC=C2F)CCC3=C(NN=C3)C4=CC=C(C=C4)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1=CC2=CC=CC=C2F)CCC3=C(NN=C3)C4=CC=C(C=C4)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H23F2N3.C2H2O4/c24-21-7-5-18(6-8-21)23-20(16-26-27-23)11-14-28-12-9-17(10-13-28)15-19-3-1-2-4-22(19)25;3-1(4)2(5)6/h1-8,15-16H,9-14H2,(H,26,27);(H,3,4)(H,5,6)