(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-(4-chloranyl-3-nitro-phenyl)methanone

Systemtic Name: (4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-(4-chloranyl-3-nitro-phenyl)methanone Openeye Name: (4-bromo-3,5-dimethyl-pyrazol-1-yl)-(4-chloro-3-nitro-phenyl)methanone CAS Name: (4-bromo-3,5-dimethyl-1-pyrazolyl)-(4-chloro-3-nitrophenyl)methanone IUPAC Name: (4-bromo-3,5-dimethylpyrazol-1-yl)-(4-chloro-3-nitrophenyl)methanone Traditional Name: (4-bromo-3,5-dimethyl-pyrazol-1-yl)-(4-chloro-3-nitro-phenyl)methanone Formula: C12H9BrClN3O3 MolecularWeight: 358.57516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C)Br

InChI

InChI=1S/C12H9BrClN3O3/c1-6-11(13)7(2)16(15-6)12(18)8-3-4-9(14)10(5-8)17(19)20/h3-5H,1-2H3