[4-[(E)-[2-(4-nitropyrazol-1-yl)ethanoylhydrazinylidene]methyl]phenyl] 2-nitrobenzoate

Systemtic Name: [4-[(E)-[2-(4-nitropyrazol-1-yl)ethanoylhydrazinylidene]methyl]phenyl] 2-nitrobenzoate Openeye Name: [4-[(E)-[[2-(4-nitropyrazol-1-yl)acetyl]hydrazono]methyl]phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [4-[(E)-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(4-nitropyrazol-1-yl)acetyl]hydrazinylidene]methyl]phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [4-[(E)-[[2-(4-nitropyrazol-1-yl)acetyl]hydrazono]methyl]phenyl] ester Formula: C19H14N6O7 MolecularWeight: 438.35046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)CN3C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)CN3C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H14N6O7/c26-18(12-23-11-14(10-21-23)24(28)29)22-20-9-13-5-7-15(8-6-13)32-19(27)16-3-1-2-4-17(16)25(30)31/h1-11H,12H2,(H,22,26)/b20-9+