2,7-bis(2-methyl-6-oxidanyl-hexan-2-yl)anthracene-9,10-dione

Systemtic Name: 2,7-bis(2-methyl-6-oxidanyl-hexan-2-yl)anthracene-9,10-dione Openeye Name: 2,7-bis(5-hydroxy-1,1-dimethyl-pentyl)anthracene-9,10-dione CAS Name: 2,7-bis(6-hydroxy-2-methylhexan-2-yl)anthracene-9,10-dione IUPAC Name: 2,7-bis(6-hydroxy-2-methylhexan-2-yl)anthracene-9,10-dione Traditional Name: 2,7-bis(5-hydroxy-1,1-dimethyl-pentyl)-9,10-anthraquinone Formula: C28H36O4 MolecularWeight: 436.58304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCO)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)CCCCO

Isomeric SMILES

CC(C)(CCCCO)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)CCCCO

InChI

InChI=1S/C28H36O4/c1-27(2,13-5-7-15-29)19-9-11-21-23(17-19)26(32)24-18-20(10-12-22(24)25(21)31)28(3,4)14-6-8-16-30/h9-12,17-18,29-30H,5-8,13-16H2,1-4H3