[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-4-ium-1-yl]-cyclobutyl-methanone

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-4-ium-1-yl]-cyclobutyl-methanone Openeye Name: [4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-4-ium-1-yl]-cyclobutyl-methanone CAS Name: [4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-cyclobutylmethanone IUPAC Name: [4-[(2-chloro-4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-cyclobutylmethanone Traditional Name: [4-(2-chloro-4-fluoro-benzyl)piperazin-4-ium-1-yl]-cyclobutyl-methanone Formula: C16H21ClFN2O+ MolecularWeight: 311.802143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CC[NH+](CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CC(C1)C(=O)N2CC[NH+](CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H20ClFN2O/c17-15-10-14(18)5-4-13(15)11-19-6-8-20(9-7-19)16(21)12-2-1-3-12/h4-5,10,12H,1-3,6-9,11H2/p+1