cyclopenta-1,3-diene; (4Z)-2,3,3-trimethyl-6,7-diphenyl-hepta-4,6-dien-2-ol; zirconium

Systemtic Name: cyclopenta-1,3-diene; (4Z)-2,3,3-trimethyl-6,7-diphenyl-hepta-4,6-dien-2-ol; zirconium Openeye Name: cyclopenta-1,3-diene; (4Z)-2,3,3-trimethyl-6,7-diphenyl-hepta-4,6-dien-2-ol; zirconium CAS Name: cyclopenta-1,3-diene; (4Z)-2,3,3-trimethyl-6,7-diphenyl-2-hepta-4,6-dienol; zirconium IUPAC Name: cyclopenta-1,3-diene; (4Z)-2,3,3-trimethyl-6,7-diphenylhepta-4,6-dien-2-ol; zirconium Traditional Name: cyclopenta-1,3-diene; (4Z)-2,3,3-trimethyl-6,7-diphenyl-hepta-4,6-dien-2-ol; zirconium Formula: C32H35OZr-3 MolecularWeight: 526.8437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=CC(=[C-]C1=CC=CC=C1)C2=CC=CC=C2)C(C)(C)O.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Zr]

Isomeric SMILES

CC(C)(/C=C\C(=[C-]C1=CC=CC=C1)C2=CC=CC=C2)C(C)(C)O.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Zr]

InChI

InChI=1S/C22H25O.2C5H5.Zr/c1-21(2,22(3,4)23)16-15-20(19-13-9-6-10-14-19)17-18-11-7-5-8-12-18;2*1-2-4-5-3-1;/h5-16,23H,1-4H3;2*1-5H;/q3*-1;/b16-15-;;;