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

Systemtic Name: [4-[1-[[3-(furan-2-yl)phenyl]methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[[3-(2-furyl)phenyl]methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[[3-(2-furanyl)phenyl]methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[[3-(furan-2-yl)phenyl]methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-[3-(2-furyl)benzyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C27H31N2O3+ MolecularWeight: 431.54664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC(=C4)C5=CC=CO5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC(=C4)C5=CC=CO5

InChI

InChI=1S/C27H30N2O3/c30-27(29-14-1-2-15-29)22-8-10-24(11-9-22)32-25-12-16-28(17-13-25)20-21-5-3-6-23(19-21)26-7-4-18-31-26/h3-11,18-19,25H,1-2,12-17,20H2/p+1