[2-methoxy-4-[(E)-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethanoylhydrazinylidene]methyl]phenyl] 2-methyl-3-nitro-benzoate

Systemtic Name: [2-methoxy-4-[(E)-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethanoylhydrazinylidene]methyl]phenyl] 2-methyl-3-nitro-benzoate Openeye Name: [2-methoxy-4-[(E)-[[2-(5-methyl-3-nitro-pyrazol-1-yl)acetyl]hydrazono]methyl]phenyl] 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid [2-methoxy-4-[(E)-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]hydrazinylidene]methyl]phenyl] 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid [2-methoxy-4-[(E)-[[2-(5-methyl-3-nitro-pyrazol-1-yl)acetyl]hydrazono]methyl]phenyl] ester Formula: C22H20N6O8 MolecularWeight: 496.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC(=O)N/N=C/C2=CC(=C(C=C2)OC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O8/c1-13-9-20(28(33)34)25-26(13)12-21(29)24-23-11-15-7-8-18(19(10-15)35-3)36-22(30)16-5-4-6-17(14(16)2)27(31)32/h4-11H,12H2,1-3H3,(H,24,29)/b23-11+