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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(3-methoxy-5-nitro-phenyl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(3-methoxy-5-nitro-phenyl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(3-methoxy-5-nitrophenyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(3-methoxy-5-nitrophenyl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(3-methoxy-5-nitro-phenyl)-2-furamide Formula: C16H12BrN5O7 MolecularWeight: 466.19978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H12BrN5O7/c1-28-12-5-9(4-10(6-12)21(24)25)18-16(23)14-3-2-11(29-14)7-20-8-13(17)15(19-20)22(26)27/h2-6,8H,7H2,1H3,(H,18,23)