2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methylpyridin-1-ium-2-yl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methylpyridin-1-ium-2-yl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methylpyridin-1-ium-2-yl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(3-methyl-2-pyridin-1-iumyl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(3-methylpyridin-1-ium-2-yl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methylpyridin-1-ium-2-yl)acetamide Formula: C13H16N5O3+ MolecularWeight: 290.29784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=CC=C1)NC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C([NH+]=CC=C1)NC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C13H15N5O3/c1-8-5-4-6-14-13(8)15-11(19)7-17-10(3)12(18(20)21)9(2)16-17/h4-6H,7H2,1-3H3,(H,14,15,19)/p+1