1-[[2,4,5-tris(chloranyl)phenyl]carbamoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2,4,5-tris(chloranyl)phenyl]carbamoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,4,5-trichlorophenyl)carbamoyl]piperidine-4-carboxylic acid CAS Name: 1-[oxo-(2,4,5-trichloroanilino)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,4,5-trichlorophenyl)carbamoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,4,5-trichlorophenyl)carbamoyl]isonipecotic acid Formula: C13H13Cl3N2O3 MolecularWeight: 351.61292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C13H13Cl3N2O3/c14-8-5-10(16)11(6-9(8)15)17-13(21)18-3-1-7(2-4-18)12(19)20/h5-7H,1-4H2,(H,17,21)(H,19,20)