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

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(4-methyl-2-nitrophenyl)acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(4-methyl-2-nitrophenyl)acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C13H12BrN5O5 MolecularWeight: 398.16888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrN5O5/c1-7-3-4-9(10(5-7)18(21)22)15-11(20)6-17-8(2)12(14)13(16-17)19(23)24/h3-5H,6H2,1-2H3,(H,15,20)