5-methyl-2-(3-methylphenyl)-4-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 5-methyl-2-(3-methylphenyl)-4-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 5-methyl-2-(m-tolyl)-4-[[(3S)-3-(3-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 5-methyl-2-(3-methylphenyl)-4-[[(3S)-3-(3-pyridinylmethoxy)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 5-methyl-2-(3-methylphenyl)-4-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 5-methyl-2-(m-tolyl)-4-[[(3S)-3-(3-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCCC(C3)OCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCC[C@@H](C3)OCC4=CN=CC=C4

InChI

InChI=1S/C23H27N3O2/c1-17-6-3-8-20(12-17)23-25-22(18(2)28-23)15-26-11-5-9-21(14-26)27-16-19-7-4-10-24-13-19/h3-4,6-8,10,12-13,21H,5,9,11,14-16H2,1-2H3/p+1/t21-/m0/s1