2-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-4-[[4-(pyridin-2-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-4-[[4-(pyridin-2-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 2-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-4-[[4-(2-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 2-(4-methoxy-2,5-dimethylphenyl)-5-methyl-4-[[4-(2-pyridinylmethoxy)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(4-methoxy-2,5-dimethylphenyl)-5-methyl-4-[[4-(pyridin-2-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 2-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-4-[[4-(2-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=NC(=C(O2)C)C[NH+]3CCC(CC3)OCC4=CC=CC=N4)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C2=NC(=C(O2)C)C[NH+]3CCC(CC3)OCC4=CC=CC=N4)C)OC

InChI

InChI=1S/C25H31N3O3/c1-17-14-24(29-4)18(2)13-22(17)25-27-23(19(3)31-25)15-28-11-8-21(9-12-28)30-16-20-7-5-6-10-26-20/h5-7,10,13-14,21H,8-9,11-12,15-16H2,1-4H3/p+1