N-(3-ethanoylphenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(3-acetylphenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(3-acetylphenyl)-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(3-acetylphenyl)-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(3-acetylphenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C13H12N4O4 MolecularWeight: 288.25878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C

InChI

InChI=1S/C13H12N4O4/c1-8(18)9-4-3-5-10(6-9)14-13(19)12-11(17(20)21)7-16(2)15-12/h3-7H,1-2H3,(H,14,19)