4-bromanyl-N-(2-methylphenyl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-(2-methylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-nitro-N-(o-tolyl)-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(2-methylphenyl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(2-methylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-nitro-N-(o-tolyl)-1H-pyrazole-5-carboxamide Formula: C11H9BrN4O3 MolecularWeight: 325.11816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H9BrN4O3/c1-6-4-2-3-5-7(6)13-11(17)9-8(12)10(15-14-9)16(18)19/h2-5H,1H3,(H,13,17)(H,14,15)