1-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(2,4-dichloro-5-fluoro-benzoyl)piperidine-3-carboxylic acid CAS Name: 1-[(2,4-dichloro-5-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(2,4-dichloro-5-fluorobenzoyl)piperidine-3-carboxylic acid Traditional Name: 1-(2,4-dichloro-5-fluoro-benzoyl)nipecotic acid Formula: C13H12Cl2FNO3 MolecularWeight: 320.143683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2Cl)Cl)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2Cl)Cl)F)C(=O)O

InChI

InChI=1S/C13H12Cl2FNO3/c14-9-5-10(15)11(16)4-8(9)12(18)17-3-1-2-7(6-17)13(19)20/h4-5,7H,1-3,6H2,(H,19,20)