2-[2-(4-fluorophenyl)-1-(5-pyridin-3-ylpentyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[2-(4-fluorophenyl)-1-(5-pyridin-3-ylpentyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[2-(4-fluorophenyl)-1-[5-(3-pyridyl)pentyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[2-(4-fluorophenyl)-1-[5-(3-pyridinyl)pentyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[2-(4-fluorophenyl)-1-(5-pyridin-3-ylpentyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[2-(4-fluorophenyl)-1-[5-(3-pyridyl)pentyl]piperazin-1-ium-1-yl]acetamide Formula: C22H30FN4O+ MolecularWeight: 385.498203

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](C(CN1)C2=CC=C(C=C2)F)(CCCCCC3=CN=CC=C3)CC(=O)N

Isomeric SMILES

C1C[N+](C(CN1)C2=CC=C(C=C2)F)(CCCCCC3=CN=CC=C3)CC(=O)N

InChI

InChI=1S/C22H29FN4O/c23-20-9-7-19(8-10-20)21-16-26-12-14-27(21,17-22(24)28)13-3-1-2-5-18-6-4-11-25-15-18/h4,6-11,15,21,26H,1-3,5,12-14,16-17H2,(H-,24,28)/p+1