2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(1-methylpyrrol-2-yl)ethanone

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(1-methylpyrrol-2-yl)ethanone Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(1-methylpyrrol-2-yl)ethanone CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-(1-methyl-2-pyrrolyl)ethanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-(1-methylpyrrol-2-yl)ethanone Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(1-methylpyrrol-2-yl)ethanone Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)C2=CC=CN2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)C2=CC=CN2C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3/c1-8-12(16(18)19)9(2)15(13-8)7-11(17)10-5-4-6-14(10)3/h4-6H,7H2,1-3H3