2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide Openeye Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-[2-(3-pyridyl)ethyl]oxazole-4-carboxamide CAS Name: 2-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-N-[2-(3-pyridinyl)ethyl]-4-oxazolecarboxamide IUPAC Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-pyridin-3-ylethyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-[2-(3-pyridyl)ethyl]oxazole-4-carboxamide Formula: C22H25FN5O2+ MolecularWeight: 410.464603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=CO2)C(=O)NCCC3=CN=CC=C3)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=CO2)C(=O)NCCC3=CN=CC=C3)C4=CC=CC=C4F

InChI

InChI=1S/C22H24FN5O2/c23-18-5-1-2-6-20(18)28-12-10-27(11-13-28)15-21-26-19(16-30-21)22(29)25-9-7-17-4-3-8-24-14-17/h1-6,8,14,16H,7,9-13,15H2,(H,25,29)/p+1