[4-[(E)-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [4-[(E)-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [4-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]-2-methoxy-phenyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [4-[(E)-[[(5-tert-butyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]-2-methoxyphenyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [4-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C24H24N4O6 MolecularWeight: 464.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N/N=C/C2=CC(=C(C=C2)OC(=O)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C24H24N4O6/c1-24(2,3)21-11-16(26-27-21)22(29)28-25-12-14-5-7-18(19(9-14)31-4)34-23(30)15-6-8-17-20(10-15)33-13-32-17/h5-12H,13H2,1-4H3,(H,26,27)(H,28,29)/b25-12+