[4-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[(4-chloro-3-fluoro-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[(4-chloro-3-fluorophenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-(4-chloro-3-fluoro-benzyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C23H27ClFN2O2+ MolecularWeight: 417.924083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C23H26ClFN2O2/c24-21-8-3-17(15-22(21)25)16-26-13-9-20(10-14-26)29-19-6-4-18(5-7-19)23(28)27-11-1-2-12-27/h3-8,15,20H,1-2,9-14,16H2/p+1