N-(4-bromanyl-2-fluoranyl-phenyl)-4-ethanoyl-piperazine-1-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-ethanoyl-piperazine-1-carboxamide Openeye Name: 4-acetyl-N-(4-bromo-2-fluoro-phenyl)piperazine-1-carboxamide CAS Name: 4-acetyl-N-(4-bromo-2-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-acetyl-N-(4-bromo-2-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-acetyl-N-(4-bromo-2-fluoro-phenyl)piperazine-1-carboxamide Formula: C13H15BrFN3O2 MolecularWeight: 344.179503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H15BrFN3O2/c1-9(19)17-4-6-18(7-5-17)13(20)16-12-3-2-10(14)8-11(12)15/h2-3,8H,4-7H2,1H3,(H,16,20)