copper 4,6-ditert-butyl-3-(2-hydroxyethylsulfanyl)benzene-1,2-diol

Systemtic Name: copper 4,6-ditert-butyl-3-(2-hydroxyethylsulfanyl)benzene-1,2-diol Openeye Name: copper 4,6-ditert-butyl-3-(2-hydroxyethylsulfanyl)benzene-1,2-diol CAS Name: copper 4,6-ditert-butyl-3-(2-hydroxyethylthio)benzene-1,2-diol IUPAC Name: copper 4,6-ditert-butyl-3-(2-hydroxyethylsulfanyl)benzene-1,2-diol Traditional Name: cupric 4,6-ditert-butyl-3-(2-hydroxyethylthio)pyrocatechol Formula: C32H52CuO6S2+2 MolecularWeight: 660.42768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1O)O)SCCO)C(C)(C)C.CC(C)(C)C1=CC(=C(C(=C1O)O)SCCO)C(C)(C)C.[Cu+2]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1O)O)SCCO)C(C)(C)C.CC(C)(C)C1=CC(=C(C(=C1O)O)SCCO)C(C)(C)C.[Cu+2]

InChI

InChI=1S/2C16H26O3S.Cu/c2*1-15(2,3)10-9-11(16(4,5)6)14(20-8-7-17)13(19)12(10)18;/h2*9,17-19H,7-8H2,1-6H3;/q;;+2