propan-2-ol; (Z)-2,2,6,6-tetramethyl-5-oxidanyl-hept-4-en-3-one; zirconium

Systemtic Name: propan-2-ol; (Z)-2,2,6,6-tetramethyl-5-oxidanyl-hept-4-en-3-one; zirconium Openeye Name: (Z)-5-hydroxy-2,2,6,6-tetramethyl-hept-4-en-3-one; propan-2-ol; zirconium CAS Name: (Z)-5-hydroxy-2,2,6,6-tetramethyl-4-hepten-3-one; 2-propanol; zirconium IUPAC Name: (Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one; propan-2-ol; zirconium Traditional Name: (Z)-5-hydroxy-2,2,6,6-tetramethyl-hept-4-en-3-one; propan-2-ol; zirconium Formula: C20H44O5Zr MolecularWeight: 455.78436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)O.CC(C)O.CC(C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Zr]

Isomeric SMILES

CC(C)O.CC(C)O.CC(C)O.CC(C)(C)/C(=C/C(=O)C(C)(C)C)/O.[Zr]

InChI

InChI=1S/C11H20O2.3C3H8O.Zr/c1-10(2,3)8(12)7-9(13)11(4,5)6;3*1-3(2)4;/h7,12H,1-6H3;3*3-4H,1-2H3;/b8-7-;;;;