N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[3-(p-tolyl)isoxazol-5-yl]acetamide CAS Name: N-[3-(4-methylphenyl)-5-isoxazolyl]-2-[(2S)-2-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[3-(p-tolyl)isoxazol-5-yl]acetamide Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=CC(=NO2)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=CC(=NO2)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H23N3O2/c1-13-6-8-15(9-7-13)16-11-18(23-20-16)19-17(22)12-21-10-4-3-5-14(21)2/h6-9,11,14H,3-5,10,12H2,1-2H3,(H,19,22)/p+1/t14-/m0/s1