N-(4-fluorophenyl)-2-[4-(3-pyridin-3-ylpropanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-(3-pyridin-3-ylpropanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-[3-(3-pyridyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[1-oxo-3-(3-pyridinyl)propyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-(3-pyridin-3-ylpropanoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-[3-(3-pyridyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C20H24FN4O2+ MolecularWeight: 371.428563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C20H23FN4O2/c21-17-4-6-18(7-5-17)23-19(26)15-24-10-12-25(13-11-24)20(27)8-3-16-2-1-9-22-14-16/h1-2,4-7,9,14H,3,8,10-13,15H2,(H,23,26)/p+1