4-tert-butyl-2-[(5-tert-butyl-3-methyl-2-oxidanyl-phenyl)-(furan-2-yl)methyl]-6-methyl-phenol; titanium(2+); dichloride

Systemtic Name: 4-tert-butyl-2-[(5-tert-butyl-3-methyl-2-oxidanyl-phenyl)-(furan-2-yl)methyl]-6-methyl-phenol; titanium(2+); dichloride Openeye Name: 4-tert-butyl-2-[(5-tert-butyl-2-hydroxy-3-methyl-phenyl)-(2-furyl)methyl]-6-methyl-phenol; titanium(2+); dichloride CAS Name: 4-tert-butyl-2-[(5-tert-butyl-2-hydroxy-3-methylphenyl)-(2-furanyl)methyl]-6-methylphenol; titanium(2+); dichloride IUPAC Name: 4-tert-butyl-2-[(5-tert-butyl-2-hydroxy-3-methylphenyl)-(furan-2-yl)methyl]-6-methylphenol; titanium(2+); dichloride Traditional Name: 4-tert-butyl-2-[(5-tert-butyl-2-hydroxy-3-methyl-phenyl)-(2-furyl)methyl]-6-methyl-phenol; titanium(2+); dichloride Formula: C27H34Cl2O3Ti MolecularWeight: 525.33006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)C)C(C2=CC=CO2)C3=CC(=CC(=C3O)C)C(C)(C)C)O.[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)C)C(C2=CC=CO2)C3=CC(=CC(=C3O)C)C(C)(C)C)O.[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C27H34O3.2ClH.Ti/c1-16-12-18(26(3,4)5)14-20(24(16)28)23(22-10-9-11-30-22)21-15-19(27(6,7)8)13-17(2)25(21)29;;;/h9-15,23,28-29H,1-8H3;2*1H;/q;;;+2/p-2