[3-[1-(furan-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [3-[1-(furan-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [3-[1-(3-furylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [3-[[1-(3-furanylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [3-[1-(furan-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [3-[1-(3-furfuryl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c24-21(23-9-1-2-10-23)18-4-3-5-20(14-18)26-19-6-11-22(12-7-19)15-17-8-13-25-16-17/h3-5,8,13-14,16,19H,1-2,6-7,9-12,15H2/p+1