1-(3-bromanyl-5-fluoranyl-phenyl)carbonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(3-bromanyl-5-fluoranyl-phenyl)carbonylpiperidine-2-carboxylic acid Openeye Name: 1-(3-bromo-5-fluoro-benzoyl)piperidine-2-carboxylic acid CAS Name: 1-[(3-bromo-5-fluorophenyl)-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-(3-bromo-5-fluorobenzoyl)piperidine-2-carboxylic acid Traditional Name: 1-(3-bromo-5-fluoro-benzoyl)pipecolinic acid Formula: C13H13BrFNO3 MolecularWeight: 330.149623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(=O)C2=CC(=CC(=C2)Br)F

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(=O)C2=CC(=CC(=C2)Br)F

InChI

InChI=1S/C13H13BrFNO3/c14-9-5-8(6-10(15)7-9)12(17)16-4-2-1-3-11(16)13(18)19/h5-7,11H,1-4H2,(H,18,19)