2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]ethanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)acetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetamide Formula: C19H14BrClN4O4 MolecularWeight: 477.69586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H14BrClN4O4/c1-11-17(20)19(25(28)29)23-24(11)10-16(26)22-15-8-7-13(21)9-14(15)18(27)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,22,26)