1-tert-butyl-3-methyl-benzene-6-ide; propan-2-olate; titanium(3+)

Systemtic Name: 1-tert-butyl-3-methyl-benzene-6-ide; propan-2-olate; titanium(3+) Openeye Name: 1-tert-butyl-3-methyl-benzene-6-ide; propan-2-olate; titanium(3+) CAS Name: 1-tert-butyl-3-methylbenzene-6-ide; 2-propanolate; titanium(3+) IUPAC Name: 1-tert-butyl-3-methylbenzene-6-ide; propan-2-olate; titanium(3+) Traditional Name: 1-tert-butyl-3-methyl-benzene-6-ide; propan-2-olate; titanium(3+) Formula: C17H29O2Ti MolecularWeight: 313.27796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[C-]C(=C1)C(C)(C)C.CC(C)[O-].CC(C)[O-].[Ti+3]

Isomeric SMILES

CC1=CC=[C-]C(=C1)C(C)(C)C.CC(C)[O-].CC(C)[O-].[Ti+3]

InChI

InChI=1S/C11H15.2C3H7O.Ti/c1-9-6-5-7-10(8-9)11(2,3)4;2*1-3(2)4;/h5-6,8H,1-4H3;2*3H,1-2H3;/q3*-1;+3