2-bromanyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)naphthalene-1,4-dione

Systemtic Name: 2-bromanyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)naphthalene-1,4-dione Openeye Name: 2-bromo-3-(3,5-ditert-butyl-4-hydroxy-phenyl)naphthalene-1,4-dione CAS Name: 2-bromo-3-(3,5-ditert-butyl-4-hydroxyphenyl)naphthalene-1,4-dione IUPAC Name: 2-bromo-3-(3,5-ditert-butyl-4-hydroxyphenyl)naphthalene-1,4-dione Traditional Name: 2-bromo-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1,4-naphthoquinone Formula: C24H25BrO3 MolecularWeight: 441.3575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=C(C(=O)C3=CC=CC=C3C2=O)Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=C(C(=O)C3=CC=CC=C3C2=O)Br

InChI

InChI=1S/C24H25BrO3/c1-23(2,3)16-11-13(12-17(22(16)28)24(4,5)6)18-19(25)21(27)15-10-8-7-9-14(15)20(18)26/h7-12,28H,1-6H3