ethanoic acid; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium

Systemtic Name: ethanoic acid; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium Openeye Name: acetic acid; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium CAS Name: acetic acid; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium IUPAC Name: acetic acid; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium Traditional Name: acetic acid; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium Formula: C16H27O6Zr- MolecularWeight: 406.60598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(C(=C1C)C)(C)C.CC(=O)O.CC(=O)O.CC(=O)O.[Zr]

Isomeric SMILES

CC1=[C-]C(C(=C1C)C)(C)C.CC(=O)O.CC(=O)O.CC(=O)O.[Zr]

InChI

InChI=1S/C10H15.3C2H4O2.Zr/c1-7-6-10(4,5)9(3)8(7)2;3*1-2(3)4;/h1-5H3;3*1H3,(H,3,4);/q-1;;;;