N'-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]ethanoyl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]ethanoyl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]acetyl]-4-fluoro-benzohydrazide CAS Name: N'-[2-[4-(4-acetyl-2-fluorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-4-fluorobenzohydrazide IUPAC Name: N'-[2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-ium-1-yl]acetyl]-4-fluorobenzohydrazide Traditional Name: N'-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]acetyl]-4-fluoro-benzohydrazide Formula: C21H23F2N4O3+ MolecularWeight: 417.429126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)NNC(=O)C3=CC=C(C=C3)F)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)NNC(=O)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C21H22F2N4O3/c1-14(28)16-4-7-19(18(23)12-16)27-10-8-26(9-11-27)13-20(29)24-25-21(30)15-2-5-17(22)6-3-15/h2-7,12H,8-11,13H2,1H3,(H,24,29)(H,25,30)/p+1