1-[[2,3,4-tris(fluoranyl)phenyl]carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[2,3,4-tris(fluoranyl)phenyl]carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,3,4-trifluorophenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[oxo-(2,3,4-trifluoroanilino)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,3,4-trifluorophenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,3,4-trifluorophenyl)carbamoyl]nipecotic acid Formula: C13H13F3N2O3 MolecularWeight: 302.24913

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=C(C(=C(C=C2)F)F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)NC2=C(C(=C(C=C2)F)F)F)C(=O)O

InChI

InChI=1S/C13H13F3N2O3/c14-8-3-4-9(11(16)10(8)15)17-13(21)18-5-1-2-7(6-18)12(19)20/h3-4,7H,1-2,5-6H2,(H,17,21)(H,19,20)