5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-furamide Formula: C17H11BrN6O8 MolecularWeight: 507.20864

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C17H11BrN6O8/c18-11-7-22(21-16(11)24(28)29)6-10-1-2-13(32-10)17(25)20-19-5-9-3-14-15(31-8-30-14)4-12(9)23(26)27/h1-5,7H,6,8H2,(H,20,25)/b19-5+