3-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide Openeye Name: 5-isopropyl-3-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]isoxazole-4-carboxamide CAS Name: 3-methyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-5-propan-2-yl-4-isoxazolecarboxamide IUPAC Name: 3-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide Traditional Name: 5-isopropyl-3-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]isoxazole-4-carboxamide Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3)C(C)C

InChI

InChI=1S/C18H24N4O3/c1-12(2)17-16(13(3)21-25-17)18(23)20-11-14-4-5-15(19-10-14)22-6-8-24-9-7-22/h4-5,10,12H,6-9,11H2,1-3H3,(H,20,23)/p+1