3-[[4-(6-fluoranyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-1,2-oxazole

Systemtic Name: 3-[[4-(6-fluoranyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-1,2-oxazole Openeye Name: 3-[[4-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-isoxazole CAS Name: 3-[[4-(6-fluoro-1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]methyl]-5-methylisoxazole IUPAC Name: 3-[[4-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-1,2-oxazole Traditional Name: 3-[[4-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-isoxazole Formula: C17H20FN4O+ MolecularWeight: 315.365303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C[NH+]2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)F

Isomeric SMILES

CC1=CC(=NO1)C[NH+]2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)F

InChI

InChI=1S/C17H19FN4O/c1-11-8-14(21-23-11)10-22-6-4-12(5-7-22)17-19-15-3-2-13(18)9-16(15)20-17/h2-3,8-9,12H,4-7,10H2,1H3,(H,19,20)/p+1