2-[4-[2-(3-fluorophenyl)ethanoyl]piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-[2-(3-fluorophenyl)ethanoyl]piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[2-(3-fluorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-(3-fluorophenyl)-1-oxoethyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[2-(3-fluorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[2-(3-fluorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C21H25FN3O2+ MolecularWeight: 370.440503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC2=CC=CC=C2)C(=O)CC3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC2=CC=CC=C2)C(=O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN3O2/c22-19-8-4-7-18(13-19)14-21(27)25-11-9-24(10-12-25)16-20(26)23-15-17-5-2-1-3-6-17/h1-8,13H,9-12,14-16H2,(H,23,26)/p+1