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

Systemtic Name: [3-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [3-[1-[(2-chloro-4-fluoro-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [3-[[1-[(2-chloro-4-fluorophenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [3-[1-[(2-chloro-4-fluorophenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [3-[1-(2-chloro-4-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=C2)OC3CC[NH+](CC3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

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

InChI

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