5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-3,5-dinitro-phenyl)furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-3,5-dinitro-phenyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-3,5-dinitro-phenyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(4-methyl-3,5-dinitrophenyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(4-methyl-3,5-dinitrophenyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-3,5-dinitro-phenyl)-2-furamide Formula: C16H11BrN6O8 MolecularWeight: 495.19794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C16H11BrN6O8/c1-8-12(21(25)26)4-9(5-13(8)22(27)28)18-16(24)14-3-2-10(31-14)6-20-7-11(17)15(19-20)23(29)30/h2-5,7H,6H2,1H3,(H,18,24)