1-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzoyl]piperidine-4-carboxylic acid CAS Name: 1-[oxo-[3-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]phenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzoyl]isonipecotic acid Formula: C21H20F3N3O4 MolecularWeight: 435.39641

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC(=CC=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC(=CC=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O4/c22-21(23,24)15-4-6-16(7-5-15)25-20(31)26-17-3-1-2-14(12-17)18(28)27-10-8-13(9-11-27)19(29)30/h1-7,12-13H,8-11H2,(H,29,30)(H2,25,26,31)