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

Systemtic Name: 4-bromanyl-N-(4-ethoxy-2-nitro-phenyl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-(4-ethoxy-2-nitro-phenyl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(4-ethoxy-2-nitrophenyl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(4-ethoxy-2-nitrophenyl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-(4-ethoxy-2-nitro-phenyl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H10BrN5O6 MolecularWeight: 400.1417

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C12H10BrN5O6/c1-2-24-6-3-4-7(8(5-6)17(20)21)14-12(19)10-9(13)11(16-15-10)18(22)23/h3-5H,2H2,1H3,(H,14,19)(H,15,16)