[2-bromanyl-4-[(E)-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]-6-methoxy-phenyl] 4-methylbenzoate

Systemtic Name: [2-bromanyl-4-[(E)-[(5-tert-butyl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]-6-methoxy-phenyl] 4-methylbenzoate Openeye Name: [2-bromo-4-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]-6-methoxy-phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-bromo-4-[(E)-[[(5-tert-butyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]-6-methoxyphenyl] ester IUPAC Name: [2-bromo-4-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]-6-methoxyphenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-bromo-4-[(E)-[(5-tert-butyl-1H-pyrazole-3-carbonyl)hydrazono]methyl]-6-methoxy-phenyl] ester Formula: C24H25BrN4O4 MolecularWeight: 513.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C=NNC(=O)C3=NNC(=C3)C(C)(C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)/C=N/NC(=O)C3=NNC(=C3)C(C)(C)C)OC

InChI

InChI=1S/C24H25BrN4O4/c1-14-6-8-16(9-7-14)23(31)33-21-17(25)10-15(11-19(21)32-5)13-26-29-22(30)18-12-20(28-27-18)24(2,3)4/h6-13H,1-5H3,(H,27,28)(H,29,30)/b26-13+