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

Systemtic Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-propan-2-yloxyethyl)-1,3-oxazole-4-carboxamide Openeye Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-isopropoxyethyl)oxazole-4-carboxamide CAS Name: 2-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-N-(2-propan-2-yloxyethyl)-4-oxazolecarboxamide IUPAC Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-propan-2-yloxyethyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-N-(2-isopropoxyethyl)oxazole-4-carboxamide Formula: C20H28FN4O3+ MolecularWeight: 391.459723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC(=O)C1=COC(=N1)C[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC(C)OCCNC(=O)C1=COC(=N1)C[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C20H27FN4O3/c1-15(2)27-12-7-22-20(26)17-14-28-19(23-17)13-24-8-10-25(11-9-24)18-6-4-3-5-16(18)21/h3-6,14-15H,7-13H2,1-2H3,(H,22,26)/p+1