phenyl-(1-propan-2-ylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane

Systemtic Name: phenyl-(1-propan-2-ylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane Openeye Name: (1-isopropylpyrazol-4-yl)-phenyl-(trifluoromethylsulfonyl)-$l^{3}-iodane CAS Name: phenyl-(1-propan-2-yl-4-pyrazolyl)-(trifluoromethylsulfonyl)-$l^{3}-iodane IUPAC Name: phenyl-(1-propan-2-ylpyrazol-4-yl)-(trifluoromethylsulfonyl)-$l^{3}-iodane Traditional Name: (1-isopropylpyrazol-4-yl)-phenyl-triflyl-$l^{3}-iodane Formula: C13H14F3IN2O2S MolecularWeight: 446.22714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=N1)I(C2=CC=CC=C2)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)N1C=C(C=N1)I(C2=CC=CC=C2)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H14F3IN2O2S/c1-10(2)19-9-12(8-18-19)17(11-6-4-3-5-7-11)22(20,21)13(14,15)16/h3-10H,1-2H3