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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-oxidanylidenepiperazin-1-yl)propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-oxopiperazin-1-yl)propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(3-oxo-1-piperazinyl)propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(3-oxopiperazin-1-yl)propanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-ketopiperazino)propionamide Formula: C13H15BrFN3O2 MolecularWeight: 344.179503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)N2CCNC(=O)C2

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Br)F)N2CCNC(=O)C2

InChI

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