3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole-1-carbonitrile

Systemtic Name: 3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole-1-carbonitrile Openeye Name: 3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole-1-carbonitrile CAS Name: 3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole-1-carbonitrile IUPAC Name: 3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole-1-carbonitrile Traditional Name: 3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole-1-carbonitrile Formula: C10H4F6INO MolecularWeight: 395.039749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OI2C#N)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(OI2C#N)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C10H4F6INO/c11-9(12,13)8(10(14,15)16)6-3-1-2-4-7(6)17(5-18)19-8/h1-4H