5-methyl-4-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)-[4-(phenylcarbonyloxy)phenyl]methyl]-2-phenyl-pyrazol-3-olate

Systemtic Name: 5-methyl-4-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)-[4-(phenylcarbonyloxy)phenyl]methyl]-2-phenyl-pyrazol-3-olate Openeye Name: 4-[(4-benzoyloxyphenyl)-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate CAS Name: 4-[(4-benzoyloxyphenyl)-(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)methyl]-5-methyl-2-phenyl-3-pyrazololate IUPAC Name: 4-[(4-benzoyloxyphenyl)-(3-methyl-5-oxido-1-phenylpyrazol-4-yl)methyl]-5-methyl-2-phenylpyrazol-3-olate Traditional Name: 4-[(4-benzoyloxyphenyl)-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Formula: C34H26N4O4-2 MolecularWeight: 554.59464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C4=C(N(N=C4C)C5=CC=CC=C5)[O-])[O-])C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C(=C1C(C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C4=C(N(N=C4C)C5=CC=CC=C5)[O-])[O-])C6=CC=CC=C6

InChI

InChI=1S/C34H28N4O4/c1-22-29(32(39)37(35-22)26-14-8-4-9-15-26)31(30-23(2)36-38(33(30)40)27-16-10-5-11-17-27)24-18-20-28(21-19-24)42-34(41)25-12-6-3-7-13-25/h3-21,31,39-40H,1-2H3/p-2