4-bromanyl-N-(2,5-dimethylpyrazol-3-yl)-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-(2,5-dimethylpyrazol-3-yl)-3-nitro-benzamide Openeye Name: 4-bromo-N-(2,5-dimethylpyrazol-3-yl)-3-nitro-benzamide CAS Name: 4-bromo-N-(2,5-dimethyl-3-pyrazolyl)-3-nitrobenzamide IUPAC Name: 4-bromo-N-(2,5-dimethylpyrazol-3-yl)-3-nitrobenzamide Traditional Name: 4-bromo-N-(2,5-dimethylpyrazol-3-yl)-3-nitro-benzamide Formula: C12H11BrN4O3 MolecularWeight: 339.14474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C

InChI

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