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

Systemtic Name: 2-(3-chlorophenyl)-5-methyl-4-[[4-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 2-(3-chlorophenyl)-5-methyl-4-[[4-(3-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole CAS Name: 2-(3-chlorophenyl)-5-methyl-4-[[4-(3-pyridinylmethoxy)-1-piperidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(3-chlorophenyl)-5-methyl-4-[[4-(pyridin-3-ylmethoxy)piperidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 2-(3-chlorophenyl)-5-methyl-4-[[4-(3-pyridylmethoxy)piperidin-1-ium-1-yl]methyl]oxazole Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)Cl)C[NH+]3CCC(CC3)OCC4=CN=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)Cl)C[NH+]3CCC(CC3)OCC4=CN=CC=C4

InChI

InChI=1S/C22H24ClN3O2/c1-16-21(25-22(28-16)18-5-2-6-19(23)12-18)14-26-10-7-20(8-11-26)27-15-17-4-3-9-24-13-17/h2-6,9,12-13,20H,7-8,10-11,14-15H2,1H3/p+1