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

Systemtic Name: 1-azido-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole Openeye Name: 1-azido-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole CAS Name: 1-azido-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole IUPAC Name: 1-azido-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole Traditional Name: 1-azido-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole Formula: C9H4F6IN3O MolecularWeight: 411.042449

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OI2N=[N+]=[N-])(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(OI2N=[N+]=[N-])(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C9H4F6IN3O/c10-8(11,12)7(9(13,14)15)5-3-1-2-4-6(5)16(20-7)18-19-17/h1-4H