(2R)-N-(4-bromanyl-2-fluoranyl-phenyl)-2-(4-ethanoylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(4-bromanyl-2-fluoranyl-phenyl)-2-(4-ethanoylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(4-bromo-2-fluoro-phenyl)propanamide CAS Name: (2R)-2-(4-acetyl-1-piperazin-1-iumyl)-N-(4-bromo-2-fluorophenyl)propanamide IUPAC Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(4-bromo-2-fluorophenyl)propanamide Traditional Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(4-bromo-2-fluoro-phenyl)propionamide Formula: C15H20BrFN3O2+ MolecularWeight: 373.240603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)Br)F)[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C15H19BrFN3O2/c1-10(19-5-7-20(8-6-19)11(2)21)15(22)18-14-4-3-12(16)9-13(14)17/h3-4,9-10H,5-8H2,1-2H3,(H,18,22)/p+1/t10-/m1/s1