5-methyl-N-[3-[(1-methylpyridin-1-ium-2-yl)carbonylamino]propyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-methyl-N-[3-[(1-methylpyridin-1-ium-2-yl)carbonylamino]propyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-methyl-N-[3-[(1-methylpyridin-1-ium-2-carbonyl)amino]propyl]isoxazole-3-carboxamide CAS Name: 5-methyl-N-[3-[[(1-methyl-2-pyridin-1-iumyl)-oxomethyl]amino]propyl]-3-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[3-[(1-methylpyridin-1-ium-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-methyl-N-[3-[(1-methylpyridin-1-ium-2-carbonyl)amino]propyl]isoxazole-3-carboxamide Formula: C15H19N4O3+ MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NCCCNC(=O)C2=CC=CC=[N+]2C

Isomeric SMILES

CC1=CC(=NO1)C(=O)NCCCNC(=O)C2=CC=CC=[N+]2C

InChI

InChI=1S/C15H18N4O3/c1-11-10-12(18-22-11)14(20)16-7-5-8-17-15(21)13-6-3-4-9-19(13)2/h3-4,6,9-10H,5,7-8H2,1-2H3,(H-,16,17,20,21)/p+1