3,3-dimethylpentane-2,4-diol; (Z)-2,2,6,6-tetramethyl-5-oxidanyl-hept-4-en-3-one; titanium

Systemtic Name: 3,3-dimethylpentane-2,4-diol; (Z)-2,2,6,6-tetramethyl-5-oxidanyl-hept-4-en-3-one; titanium Openeye Name: 3,3-dimethylpentane-2,4-diol; (Z)-5-hydroxy-2,2,6,6-tetramethyl-hept-4-en-3-one; titanium CAS Name: 3,3-dimethylpentane-2,4-diol; (Z)-5-hydroxy-2,2,6,6-tetramethyl-4-hepten-3-one; titanium IUPAC Name: 3,3-dimethylpentane-2,4-diol; (Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one; titanium Traditional Name: 3,3-dimethylpentane-2,4-diol; (Z)-5-hydroxy-2,2,6,6-tetramethyl-hept-4-en-3-one; titanium Formula: C18H36O4Ti MolecularWeight: 364.34304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20O2.C7H16O2.Ti/c1-10(2,3)8(12)7-9(13)11(4,5)6;1-5(8)7(3,4)6(2)9;/h7,12H,1-6H3;5-6,8-9H,1-4H3;/b8-7-;;