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

Systemtic Name: 2-tert-butyl-6-[(3-tert-butyl-2-oxidanyl-phenyl)-pyridin-2-yl-methyl]phenol; titanium(2+); dichloride Openeye Name: 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-phenyl)-(2-pyridyl)methyl]phenol; titanium(2+); dichloride CAS Name: 2-tert-butyl-6-[(3-tert-butyl-2-hydroxyphenyl)-(2-pyridinyl)methyl]phenol; titanium(2+); dichloride IUPAC Name: 2-tert-butyl-6-[(3-tert-butyl-2-hydroxyphenyl)-pyridin-2-ylmethyl]phenol; titanium(2+); dichloride Traditional Name: 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-phenyl)-(2-pyridyl)methyl]phenol; titanium(2+); dichloride Formula: C26H31Cl2NO2Ti MolecularWeight: 508.30284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C1O)C(C2=C(C(=CC=C2)C(C)(C)C)O)C3=CC=CC=N3.[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

CC(C)(C)C1=CC=CC(=C1O)C(C2=C(C(=CC=C2)C(C)(C)C)O)C3=CC=CC=N3.[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C26H31NO2.2ClH.Ti/c1-25(2,3)19-13-9-11-17(23(19)28)22(21-15-7-8-16-27-21)18-12-10-14-20(24(18)29)26(4,5)6;;;/h7-16,22,28-29H,1-6H3;2*1H;/q;;;+2/p-2