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

Systemtic Name: 1-(2-phenylethynyl)-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole Openeye Name: 1-(2-phenylethynyl)-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole CAS Name: 1-(2-phenylethynyl)-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole IUPAC Name: 1-(2-phenylethynyl)-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole Traditional Name: 1-(2-phenylethynyl)-3,3-bis(trifluoromethyl)-1$l^{3},2-benziodoxole Formula: C17H9F6IO MolecularWeight: 470.147649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CI2C3=CC=CC=C3C(O2)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C#CI2C3=CC=CC=C3C(O2)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H9F6IO/c18-16(19,20)15(17(21,22)23)13-8-4-5-9-14(13)24(25-15)11-10-12-6-2-1-3-7-12/h1-9H