1-[[2,4,5-tris(chloranyl)phenyl]carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[2,4,5-tris(chloranyl)phenyl]carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4,5-trichlorophenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[oxo-(2,4,5-trichloroanilino)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4,5-trichlorophenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4,5-trichlorophenyl)carbamoyl]nipecotic acid Formula: C13H13Cl3N2O3 MolecularWeight: 351.61292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl)C(=O)O

InChI

InChI=1S/C13H13Cl3N2O3/c14-8-4-10(16)11(5-9(8)15)17-13(21)18-3-1-2-7(6-18)12(19)20/h4-5,7H,1-3,6H2,(H,17,21)(H,19,20)