2-ethyl-4-[4-[1,1,1,3,3,3-hexakis(fluoranyl)-2-(trifluoromethyl)propan-2-yl]phenyl]-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-ethyl-4-[4-[1,1,1,3,3,3-hexakis(fluoranyl)-2-(trifluoromethyl)propan-2-yl]phenyl]-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-ethyl-4-[4-[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]phenyl]-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-ethyl-4-[4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]phenyl]-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-ethyl-4-[4-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]phenyl]-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-ethyl-4-[4-[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]phenyl]-1H-inden-1-ide; zirconium(2+); dichloride Formula: C21H14Cl2F9Zr- MolecularWeight: 599.451489

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C21H14F9.2ClH.Zr/c1-2-12-10-14-4-3-5-16(17(14)11-12)13-6-8-15(9-7-13)18(19(22,23)24,20(25,26)27)21(28,29)30;;;/h3-11H,2H2,1H3;2*1H;/q-1;;;+2/p-2