4-bromanyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitro-benzamide Openeye Name: 4-bromo-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitro-benzamide CAS Name: 4-bromo-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitrobenzamide IUPAC Name: 4-bromo-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitrobenzamide Traditional Name: 4-bromo-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitro-benzamide Formula: C12H11BrN4O3 MolecularWeight: 339.14474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H11BrN4O3/c1-6-11(7(2)16-15-6)14-12(18)8-3-4-9(13)10(5-8)17(19)20/h3-5H,1-2H3,(H,14,18)(H,15,16)