N-(4-chloranyl-2-fluoranyl-phenyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide Formula: C16H20ClFN3O2+ MolecularWeight: 340.800303

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C16H19ClFN3O2/c17-12-3-4-14(13(18)9-12)19-15(22)10-20-5-7-21(8-6-20)16(23)11-1-2-11/h3-4,9,11H,1-2,5-8,10H2,(H,19,22)/p+1