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

Systemtic Name: [4-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[(2-fluoro-4-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[(2-fluoro-4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[(2-fluoro-4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-(2-fluoro-4-methoxy-benzyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C24H30FN2O3+ MolecularWeight: 413.505003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4)F

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4)F

InChI

InChI=1S/C24H29FN2O3/c1-29-22-9-6-19(23(25)16-22)17-26-14-10-21(11-15-26)30-20-7-4-18(5-8-20)24(28)27-12-2-3-13-27/h4-9,16,21H,2-3,10-15,17H2,1H3/p+1