1-(5-fluoranyl-1H-indol-3-yl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(5-fluoranyl-1H-indol-3-yl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzylpiperidin-1-ium-1-yl)-1-(5-fluoro-1H-indol-3-yl)ethanone CAS Name: 1-(5-fluoro-1H-indol-3-yl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 2-(4-benzylpiperidin-1-ium-1-yl)-1-(5-fluoro-1H-indol-3-yl)ethanone Traditional Name: 2-(4-benzylpiperidin-1-ium-1-yl)-1-(5-fluoro-1H-indol-3-yl)ethanone Formula: C22H24FN2O+ MolecularWeight: 351.437163

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)C3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)C3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C22H23FN2O/c23-18-6-7-21-19(13-18)20(14-24-21)22(26)15-25-10-8-17(9-11-25)12-16-4-2-1-3-5-16/h1-7,13-14,17,24H,8-12,15H2/p+1