(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-phenyl-(trifluoromethylsulfonyl)-$l^{3}-iodane

Systemtic Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)-phenyl-(trifluoromethylsulfonyl)-$l^{3}-iodane Openeye Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)-phenyl-(trifluoromethylsulfonyl)-$l^{3}-iodane CAS Name: (1-ethyl-3,5-dimethyl-4-pyrazolyl)-phenyl-(trifluoromethylsulfonyl)-$l^{3}-iodane IUPAC Name: (1-ethyl-3,5-dimethylpyrazol-4-yl)-phenyl-(trifluoromethylsulfonyl)-$l^{3}-iodane Traditional Name: (1-ethyl-3,5-dimethyl-pyrazol-4-yl)-phenyl-triflyl-$l^{3}-iodane Formula: C14H16F3IN2O2S MolecularWeight: 460.25372

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)I(C2=CC=CC=C2)S(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)I(C2=CC=CC=C2)S(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C14H16F3IN2O2S/c1-4-20-11(3)13(10(2)19-20)18(12-8-6-5-7-9-12)23(21,22)14(15,16)17/h5-9H,4H2,1-3H3