N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-oxidanylidenepiperazin-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-oxidanylidenepiperazin-1-yl)ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-oxopiperazin-1-yl)acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(3-oxo-1-piperazinyl)acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(3-oxopiperazin-1-yl)acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-ketopiperazino)acetamide Formula: C12H13BrFN3O2 MolecularWeight: 330.152923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1CN(CC(=O)N1)CC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C12H13BrFN3O2/c13-8-1-2-10(9(14)5-8)16-12(19)7-17-4-3-15-11(18)6-17/h1-2,5H,3-4,6-7H2,(H,15,18)(H,16,19)