2-[(E)-[[5-[(4-bromanylpyrazol-1-yl)methyl]furan-2-yl]carbonylhydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(E)-[[5-[(4-bromanylpyrazol-1-yl)methyl]furan-2-yl]carbonylhydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(E)-[[5-[(4-bromopyrazol-1-yl)methyl]furan-2-carbonyl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[(E)-[[[5-[(4-bromo-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(E)-[[5-[(4-bromopyrazol-1-yl)methyl]furan-2-carbonyl]hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(E)-[[5-[(4-bromopyrazol-1-yl)methyl]-2-furoyl]hydrazono]methyl]-4-nitro-phenolate Formula: C16H11BrN5O5- MolecularWeight: 433.19304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrN5O5/c17-11-7-19-21(8-11)9-13-2-4-15(27-13)16(24)20-18-6-10-5-12(22(25)26)1-3-14(10)23/h1-8,23H,9H2,(H,20,24)/p-1/b18-6+