1H-inden-1-ide; 2-methylcyclopenta-1,3-diene; propan-2-ylidenezirconium; 4-(trifluoromethyl)phenol

Systemtic Name: 1H-inden-1-ide; 2-methylcyclopenta-1,3-diene; propan-2-ylidenezirconium; 4-(trifluoromethyl)phenol Openeye Name: 1H-inden-1-ide; isopropylidenezirconium; 2-methylcyclopenta-1,3-diene; 4-(trifluoromethyl)phenol CAS Name: 1H-inden-1-ide; 2-methylcyclopenta-1,3-diene; propan-2-ylidenezirconium; 4-(trifluoromethyl)phenol IUPAC Name: 1H-inden-1-ide; 2-methylcyclopenta-1,3-diene; propan-2-ylidenezirconium; 4-(trifluoromethyl)phenol Traditional Name: 1H-inden-1-ide; isopropylidenezirconium; 2-methylcyclopenta-1,3-diene; 4-(trifluoromethyl)phenol Formula: C32H30F6O2Zr-2 MolecularWeight: 651.793819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.CC(=[Zr])C.[CH-]1C=CC2=CC=CC=C21.C1=CC(=CC=C1C(F)(F)F)O.C1=CC(=CC=C1C(F)(F)F)O

Isomeric SMILES

CC1=[C-]CC=C1.CC(=[Zr])C.[CH-]1C=CC2=CC=CC=C21.C1=CC(=CC=C1C(F)(F)F)O.C1=CC(=CC=C1C(F)(F)F)O

InChI

InChI=1S/C9H7.2C7H5F3O.C6H7.C3H6.Zr/c1-2-5-9-7-3-6-8(9)4-1;2*8-7(9,10)5-1-3-6(11)4-2-5;1-6-4-2-3-5-6;1-3-2;/h1-7H;2*1-4,11H;2,4H,3H2,1H3;1-2H3;/q-1;;;-1;;