2-(2-ethoxyphenyl)-5-methyl-4-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(2-ethoxyphenyl)-5-methyl-4-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 2-(2-ethoxyphenyl)-5-methyl-4-[[(2S)-2-(2-pyridyl)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 2-(2-ethoxyphenyl)-5-methyl-4-[[(2S)-2-(2-pyridinyl)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(2-ethoxyphenyl)-5-methyl-4-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 5-methyl-2-o-phenetyl-4-[[(2S)-2-(2-pyridyl)piperidin-1-ium-1-yl]methyl]oxazole Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+]3CCCCC3C4=CC=CC=N4

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+]3CCCC[C@H]3C4=CC=CC=N4

InChI

InChI=1S/C23H27N3O2/c1-3-27-22-13-5-4-10-18(22)23-25-20(17(2)28-23)16-26-15-9-7-12-21(26)19-11-6-8-14-24-19/h4-6,8,10-11,13-14,21H,3,7,9,12,15-16H2,1-2H3/p+1/t21-/m0/s1