1-[(3-chloranyl-2-fluoranyl-phenyl)carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-chloranyl-2-fluoranyl-phenyl)carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-chloro-2-fluoro-phenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-chloro-2-fluoroanilino)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-chloro-2-fluorophenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3-chloro-2-fluoro-phenyl)carbamoyl]nipecotic acid Formula: C13H14ClFN2O3 MolecularWeight: 300.713263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClFN2O3/c14-9-4-1-5-10(11(9)15)16-13(20)17-6-2-3-8(7-17)12(18)19/h1,4-5,8H,2-3,6-7H2,(H,16,20)(H,18,19)