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

Systemtic Name: 4-[(4-iodophenyl)-(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Openeye Name: 4-[(4-iodophenyl)-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate CAS Name: 4-[(4-iodophenyl)-(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)methyl]-5-methyl-2-phenyl-3-pyrazololate IUPAC Name: 4-[(4-iodophenyl)-(3-methyl-5-oxido-1-phenylpyrazol-4-yl)methyl]-5-methyl-2-phenylpyrazol-3-olate Traditional Name: 4-[(4-iodophenyl)-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-pyrazol-3-olate Formula: C27H21IN4O2-2 MolecularWeight: 560.38571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(C2=CC=C(C=C2)I)C3=C(N(N=C3C)C4=CC=CC=C4)[O-])[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(C2=CC=C(C=C2)I)C3=C(N(N=C3C)C4=CC=CC=C4)[O-])[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H23IN4O2/c1-17-23(26(33)31(29-17)21-9-5-3-6-10-21)25(19-13-15-20(28)16-14-19)24-18(2)30-32(27(24)34)22-11-7-4-8-12-22/h3-16,25,33-34H,1-2H3/p-2