1-[(4-bromanyl-2-fluoranyl-phenyl)carbamoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-bromanyl-2-fluoranyl-phenyl)carbamoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-bromo-2-fluoroanilino)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-bromo-2-fluorophenyl)carbamoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]isonipecotic acid Formula: C13H14BrFN2O3 MolecularWeight: 345.164263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H14BrFN2O3/c14-9-1-2-11(10(15)7-9)16-13(20)17-5-3-8(4-6-17)12(18)19/h1-2,7-8H,3-6H2,(H,16,20)(H,18,19)