3-(2-chlorophenyl)-5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]isoxazole-4-carboxamide Formula: C24H27ClN3O2+ MolecularWeight: 424.94308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

InChI

InChI=1S/C24H26ClN3O2/c1-17-22(23(27-30-17)20-11-5-6-12-21(20)25)24(29)26-15-18-9-3-4-10-19(18)16-28-13-7-2-8-14-28/h3-6,9-12H,2,7-8,13-16H2,1H3,(H,26,29)/p+1