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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])Br)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])Br)C)Cl

InChI

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