[3-[(E)-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] 2-chloranylbenzoate

Systemtic Name: [3-[(E)-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] 2-chloranylbenzoate Openeye Name: [3-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]phenyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [3-[(E)-[[(5-tert-butyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [3-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]phenyl] ester Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N/N=C/C2=CC(=CC=C2)OC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H21ClN4O3/c1-22(2,3)19-12-18(25-26-19)20(28)27-24-13-14-7-6-8-15(11-14)30-21(29)16-9-4-5-10-17(16)23/h4-13H,1-3H3,(H,25,26)(H,27,28)/b24-13+