5-[(6-methylpyridin-3-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(6-methylpyridin-3-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[(6-methyl-3-pyridyl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-3-carboxamide CAS Name: 5-[(6-methyl-3-pyridinyl)oxymethyl]-N-[3-(4-morpholin-4-iumyl)propyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(6-methylpyridin-3-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[(6-methyl-3-pyridyl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)isoxazole-3-carboxamide Formula: C18H25N4O4+ MolecularWeight: 361.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)OCC2=CC(=NO2)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC=C(C=C1)OCC2=CC(=NO2)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H24N4O4/c1-14-3-4-15(12-20-14)25-13-16-11-17(21-26-16)18(23)19-5-2-6-22-7-9-24-10-8-22/h3-4,11-12H,2,5-10,13H2,1H3,(H,19,23)/p+1