3-tert-butylphenol; cyclopenta-1,4-dien-1-yl(trimethyl)silane; propan-2-ylidenetitanium(1+); dichloride

Systemtic Name: 3-tert-butylphenol; cyclopenta-1,4-dien-1-yl(trimethyl)silane; propan-2-ylidenetitanium(1+); dichloride Openeye Name: 3-tert-butylphenol; cyclopenta-1,4-dien-1-yl(trimethyl)silane; isopropylidenetitanium(1+); dichloride CAS Name: 3-tert-butylphenol; 1-cyclopenta-1,4-dienyl(trimethyl)silane; propan-2-ylidenetitanium(1+); dichloride IUPAC Name: 3-tert-butylphenol; cyclopenta-1,4-dien-1-yl(trimethyl)silane; propan-2-ylidenetitanium(1+); dichloride Traditional Name: 3-tert-butylphenol; cyclopenta-1,4-dien-1-yl(trimethyl)silane; isopropylidenetitanium(1+); dichloride Formula: C21H33Cl2OSiTi-2 MolecularWeight: 448.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[Ti+])C.CC(C)(C)C1=CC(=CC=C1)O.C[Si](C)(C)C1=[C-]CC=C1.[Cl-].[Cl-]

Isomeric SMILES

CC(=[Ti+])C.CC(C)(C)C1=CC(=CC=C1)O.C[Si](C)(C)C1=[C-]CC=C1.[Cl-].[Cl-]

InChI

InChI=1S/C10H14O.C8H13Si.C3H6.2ClH.Ti/c1-10(2,3)8-5-4-6-9(11)7-8;1-9(2,3)8-6-4-5-7-8;1-3-2;;;/h4-7,11H,1-3H3;4,6H,5H2,1-3H3;1-2H3;2*1H;/q;-1;;;;+1/p-2