[4-[(E)-[(5-methyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [4-[(E)-[(5-methyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] 3-methyl-4-nitro-benzoate Openeye Name: [4-[(E)-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]phenyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [4-[(E)-[[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [4-[(E)-[(5-methyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]phenyl] ester Formula: C20H17N5O5 MolecularWeight: 407.37948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1)C(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H17N5O5/c1-12-9-15(5-8-18(12)25(28)29)20(27)30-16-6-3-14(4-7-16)11-21-24-19(26)17-10-13(2)22-23-17/h3-11H,1-2H3,(H,22,23)(H,24,26)/b21-11+