[5-[1-[(3-fluorophenyl)methyl]-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [5-[1-[(3-fluorophenyl)methyl]-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-yl]-piperidin-1-yl-methanone Openeye Name: [5-[1-[(3-fluorophenyl)methyl]-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-yl]-(1-piperidyl)methanone CAS Name: [5-[1-[(3-fluorophenyl)methyl]-4-hydroxy-4-piperidin-1-iumyl]-2-benzofuranyl]-(1-piperidinyl)methanone IUPAC Name: [5-[1-[(3-fluorophenyl)methyl]-4-hydroxypiperidin-1-ium-4-yl]-1-benzofuran-2-yl]-piperidin-1-ylmethanone Traditional Name: [5-[1-(3-fluorobenzyl)-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-yl]-piperidino-methanone Formula: C26H30FN2O3+ MolecularWeight: 437.526403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5=CC(=CC=C5)F)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5=CC(=CC=C5)F)O

InChI

InChI=1S/C26H29FN2O3/c27-22-6-4-5-19(15-22)18-28-13-9-26(31,10-14-28)21-7-8-23-20(16-21)17-24(32-23)25(30)29-11-2-1-3-12-29/h4-8,15-17,31H,1-3,9-14,18H2/p+1