2,4-ditert-butyl-5-methyl-phenol; thiophen-2-ylmethylidenetitanium; dichloride

Systemtic Name: 2,4-ditert-butyl-5-methyl-phenol; thiophen-2-ylmethylidenetitanium; dichloride Openeye Name: 2,4-ditert-butyl-5-methyl-phenol; 2-thienylmethylenetitanium; dichloride CAS Name: 2,4-ditert-butyl-5-methylphenol; thiophen-2-ylmethylidenetitanium; dichloride IUPAC Name: 2,4-ditert-butyl-5-methylphenol; thiophen-2-ylmethylidenetitanium; dichloride Traditional Name: 2,4-ditert-butyl-5-methyl-phenol; 2-thenylidenetitanium; dichloride Formula: C35H52Cl2O2STi-2 MolecularWeight: 655.62418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O.CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O.C1=CSC(=C1)C=[Ti].[Cl-].[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O.CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O.C1=CSC(=C1)C=[Ti].[Cl-].[Cl-]

InChI

InChI=1S/2C15H24O.C5H4S.2ClH.Ti/c2*1-10-8-13(16)12(15(5,6)7)9-11(10)14(2,3)4;1-5-3-2-4-6-5;;;/h2*8-9,16H,1-7H3;1-4H;2*1H;/p-2