3-(2-chlorophenyl)-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-4-carboxamide Formula: C18H23ClN3O3+ MolecularWeight: 364.84652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H22ClN3O3/c1-13-16(17(21-25-13)14-5-2-3-6-15(14)19)18(23)20-7-4-8-22-9-11-24-12-10-22/h2-3,5-6H,4,7-12H2,1H3,(H,20,23)/p+1