2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methyl-4-[[4-(pyridin-2-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methyl-4-[[4-(pyridin-2-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methyl-4-[[4-(2-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methyl-4-[[4-(2-pyridinylmethoxy)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methyl-4-[[4-(pyridin-2-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methyl-4-[[4-(2-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole Formula: C24H28N3O5+ MolecularWeight: 438.49622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC3=C(C(=C2)OC)OCO3)C[NH+]4CCC(CC4)OCC5=CC=CC=N5

Isomeric SMILES

CC1=C(N=C(O1)C2=CC3=C(C(=C2)OC)OCO3)C[NH+]4CCC(CC4)OCC5=CC=CC=N5

InChI

InChI=1S/C24H27N3O5/c1-16-20(13-27-9-6-19(7-10-27)29-14-18-5-3-4-8-25-18)26-24(32-16)17-11-21(28-2)23-22(12-17)30-15-31-23/h3-5,8,11-12,19H,6-7,9-10,13-15H2,1-2H3/p+1