4-bromanyl-2-ethyl-N-(4-methyl-3,5-dinitro-phenyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-ethyl-N-(4-methyl-3,5-dinitro-phenyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-ethyl-N-(4-methyl-3,5-dinitro-phenyl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-ethyl-N-(4-methyl-3,5-dinitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-ethyl-N-(4-methyl-3,5-dinitrophenyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-2-ethyl-N-(4-methyl-3,5-dinitro-phenyl)pyrazole-3-carboxamide Formula: C13H12BrN5O5 MolecularWeight: 398.16888

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C13H12BrN5O5/c1-3-17-12(9(14)6-15-17)13(20)16-8-4-10(18(21)22)7(2)11(5-8)19(23)24/h4-6H,3H2,1-2H3,(H,16,20)