(3S)-1-(4-bromanyl-2-fluoranyl-phenyl)carbonylpiperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-bromanyl-2-fluoranyl-phenyl)carbonylpiperidine-3-carboxamide Openeye Name: (3S)-1-(4-bromo-2-fluoro-benzoyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(4-bromo-2-fluorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-bromo-2-fluorobenzoyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-bromo-2-fluoro-benzoyl)nipecotamide Formula: C13H14BrFN2O2 MolecularWeight: 329.164863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=C(C=C(C=C2)Br)F)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=C(C=C(C=C2)Br)F)C(=O)N

InChI

InChI=1S/C13H14BrFN2O2/c14-9-3-4-10(11(15)6-9)13(19)17-5-1-2-8(7-17)12(16)18/h3-4,6,8H,1-2,5,7H2,(H2,16,18)/t8-/m0/s1