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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-2-furamide Formula: C23H18BrN5O7 MolecularWeight: 556.32232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br)C

InChI

InChI=1S/C23H18BrN5O7/c1-13-5-14(2)7-18(6-13)35-19-9-15(8-16(10-19)28(31)32)25-23(30)21-4-3-17(36-21)11-27-12-20(24)22(26-27)29(33)34/h3-10,12H,11H2,1-2H3,(H,25,30)