4-bromanyl-N-[4-[ethanoyl(methyl)amino]phenyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-[4-[ethanoyl(methyl)amino]phenyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[4-[acetyl(methyl)amino]phenyl]-4-bromo-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[4-[acetyl(methyl)amino]phenyl]-4-bromo-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[4-[acetyl(methyl)amino]phenyl]-4-bromo-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[4-[acetyl(methyl)amino]phenyl]-4-bromo-3-nitro-1H-pyrazole-5-carboxamide Formula: C13H12BrN5O4 MolecularWeight: 382.16948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H12BrN5O4/c1-7(20)18(2)9-5-3-8(4-6-9)15-13(21)11-10(14)12(17-16-11)19(22)23/h3-6H,1-2H3,(H,15,21)(H,16,17)