4-tert-butyl-2-[3,6,8-tris(5-tert-butyl-2-oxidanyl-phenyl)pyren-1-yl]phenol

Systemtic Name: 4-tert-butyl-2-[3,6,8-tris(5-tert-butyl-2-oxidanyl-phenyl)pyren-1-yl]phenol Openeye Name: 4-tert-butyl-2-[3,6,8-tris(5-tert-butyl-2-hydroxy-phenyl)pyren-1-yl]phenol CAS Name: 4-tert-butyl-2-[3,6,8-tris(5-tert-butyl-2-hydroxyphenyl)-1-pyrenyl]phenol IUPAC Name: 4-tert-butyl-2-[3,6,8-tris(5-tert-butyl-2-hydroxyphenyl)pyren-1-yl]phenol Traditional Name: 4-tert-butyl-2-[3,6,8-tris(5-tert-butyl-2-hydroxy-phenyl)pyren-1-yl]phenol Formula: C56H58O4 MolecularWeight: 795.05732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)C2=CC(=C3C=CC4=C(C=C(C5=C4C3=C2C=C5)C6=C(C=CC(=C6)C(C)(C)C)O)C7=C(C=CC(=C7)C(C)(C)C)O)C8=C(C=CC(=C8)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)C2=CC(=C3C=CC4=C(C=C(C5=C4C3=C2C=C5)C6=C(C=CC(=C6)C(C)(C)C)O)C7=C(C=CC(=C7)C(C)(C)C)O)C8=C(C=CC(=C8)C(C)(C)C)O

InChI

InChI=1S/C56H58O4/c1-53(2,3)31-13-21-47(57)43(25-31)39-29-40(44-26-32(54(4,5)6)14-22-48(44)58)36-19-20-38-42(46-28-34(56(10,11)12)16-24-50(46)60)30-41(37-18-17-35(39)51(36)52(37)38)45-27-33(55(7,8)9)15-23-49(45)59/h13-30,57-60H,1-12H3