2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]-N-(propan-2-ylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-N-(isopropylcarbamoyl)acetamide CAS Name: 2-[4-(4-acetyl-2-fluorophenyl)-1-piperazin-1-iumyl]-N-[oxo-(propan-2-ylamino)methyl]acetamide IUPAC Name: 2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-ium-1-yl]-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-N-(isopropylcarbamoyl)acetamide Formula: C18H26FN4O3+ MolecularWeight: 365.422443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)C)F

Isomeric SMILES

CC(C)NC(=O)NC(=O)C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)C)F

InChI

InChI=1S/C18H25FN4O3/c1-12(2)20-18(26)21-17(25)11-22-6-8-23(9-7-22)16-5-4-14(13(3)24)10-15(16)19/h4-5,10,12H,6-9,11H2,1-3H3,(H2,20,21,25,26)/p+1