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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-(2-methoxyphenoxy)-5-nitro-phenyl]-2-furamide Formula: C22H16BrN5O8 MolecularWeight: 558.29514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

InChI

InChI=1S/C22H16BrN5O8/c1-34-18-4-2-3-5-19(18)36-16-9-13(8-14(10-16)27(30)31)24-22(29)20-7-6-15(35-20)11-26-12-17(23)21(25-26)28(32)33/h2-10,12H,11H2,1H3,(H,24,29)