[2-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [2-[1-[(4-chloro-3-fluoro-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [2-[[1-[(4-chloro-3-fluorophenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [2-[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=CC=C2OC3CC[NH+](CC3)CC4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C23H26ClFN2O2/c24-20-8-7-17(15-21(20)25)16-26-13-9-18(10-14-26)29-22-6-2-1-5-19(22)23(28)27-11-3-4-12-27/h1-2,5-8,15,18H,3-4,9-14,16H2/p+1