bis(oxidanylidene)uranium; 4-tert-butyl-2-[[5-tert-butyl-3-[(5-tert-butyl-2-oxidanyl-phenyl)methyl]-2-oxidanyl-phenyl]methyl]phenolate

Systemtic Name: bis(oxidanylidene)uranium; 4-tert-butyl-2-[[5-tert-butyl-3-[(5-tert-butyl-2-oxidanyl-phenyl)methyl]-2-oxidanyl-phenyl]methyl]phenolate Openeye Name: 4-tert-butyl-2-[[5-tert-butyl-3-[(5-tert-butyl-2-hydroxy-phenyl)methyl]-2-hydroxy-phenyl]methyl]phenolate; dioxouranium CAS Name: 4-tert-butyl-2-[[5-tert-butyl-3-[(5-tert-butyl-2-hydroxyphenyl)methyl]-2-hydroxyphenyl]methyl]phenolate; dioxouranium IUPAC Name: 4-tert-butyl-2-[[5-tert-butyl-3-[(5-tert-butyl-2-hydroxyphenyl)methyl]-2-hydroxyphenyl]methyl]phenolate; dioxouranium Traditional Name: 4-tert-butyl-2-[5-tert-butyl-3-(5-tert-butyl-2-hydroxy-benzyl)-2-hydroxy-benzyl]phenolate; diketouranium Formula: C64H82O8U-2 MolecularWeight: 1217.35999

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C(C)(C)C)[O-])C(C)(C)C.CC(C)(C)C1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C(C)(C)C)[O-])C(C)(C)C.O=[U]=O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C(C)(C)C)[O-])C(C)(C)C.CC(C)(C)C1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C(C)(C)C)[O-])C(C)(C)C.O=[U]=O

InChI

InChI=1S/2C32H42O3.2O.U/c2*1-30(2,3)24-10-12-27(33)20(16-24)14-22-18-26(32(7,8)9)19-23(29(22)35)15-21-17-25(31(4,5)6)11-13-28(21)34;;;/h2*10-13,16-19,33-35H,14-15H2,1-9H3;;;/p-2