[5-[1-[(E)-3-(furan-2-yl)prop-2-enyl]-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-[1-[(E)-3-(furan-2-yl)prop-2-enyl]-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-[1-[(E)-3-(2-furyl)allyl]-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-yl]-pyrrolidin-1-yl-methanone CAS Name: [5-[1-[(E)-3-(2-furanyl)prop-2-enyl]-4-hydroxy-4-piperidin-1-iumyl]-2-benzofuranyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-[1-[(E)-3-(furan-2-yl)prop-2-enyl]-4-hydroxypiperidin-1-ium-4-yl]-1-benzofuran-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-[1-[(E)-3-(2-furyl)allyl]-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-yl]-pyrrolidino-methanone Formula: C25H29N2O4+ MolecularWeight: 421.50876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC=CC5=CC=CO5)O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)C/C=C/C5=CC=CO5)O

InChI

InChI=1S/C25H28N2O4/c28-24(27-12-1-2-13-27)23-18-19-17-20(7-8-22(19)31-23)25(29)9-14-26(15-10-25)11-3-5-21-6-4-16-30-21/h3-8,16-18,29H,1-2,9-15H2/p+1/b5-3+