phenyl-(1-phenylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane

Systemtic Name: phenyl-(1-phenylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane Openeye Name: phenyl-(1-phenylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane CAS Name: phenyl-(1-phenyl-4-pyrazolyl)-(trifluoromethylsulfonyl)-$l^{3}-iodane IUPAC Name: phenyl-(1-phenylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane Traditional Name: phenyl-(1-phenylpyrazol-4-yl)-triflyl-$l^{3}-iodane Formula: C16H12F3IN2O2S MolecularWeight: 480.24336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)I(C3=CC=CC=C3)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)I(C3=CC=CC=C3)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H12F3IN2O2S/c17-16(18,19)25(23,24)20(13-7-3-1-4-8-13)14-11-21-22(12-14)15-9-5-2-6-10-15/h1-12H