2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(2-chloranyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(2-chloranyl-5-nitro-phenyl)ethanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(2-chloro-5-nitro-phenyl)acetamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(2-chloro-5-nitrophenyl)acetamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(2-chloro-5-nitrophenyl)acetamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(2-chloro-5-nitro-phenyl)acetamide Formula: C13H12BrClN4O3 MolecularWeight: 387.61638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C)Br

InChI

InChI=1S/C13H12BrClN4O3/c1-7-13(14)8(2)18(17-7)6-12(20)16-11-5-9(19(21)22)3-4-10(11)15/h3-5H,6H2,1-2H3,(H,16,20)