1-[4-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-(3-chlorobenzyl)piperazin-4-ium-1-yl]-3-fluoro-phenyl]ethanone Formula: C19H21ClFN2O+ MolecularWeight: 347.834243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClFN2O/c1-14(24)16-5-6-19(18(21)12-16)23-9-7-22(8-10-23)13-15-3-2-4-17(20)11-15/h2-6,11-12H,7-10,13H2,1H3/p+1