2,7-ditert-butyl-10b,10c-dimethyl-5,10-bis(oxidanyl)pyrene-4,9-dione

Systemtic Name: 2,7-ditert-butyl-10b,10c-dimethyl-5,10-bis(oxidanyl)pyrene-4,9-dione Openeye Name: 2,7-ditert-butyl-5,10-dihydroxy-10b,10c-dimethyl-pyrene-4,9-dione CAS Name: 2,7-ditert-butyl-5,10-dihydroxy-10b,10c-dimethylpyrene-4,9-dione IUPAC Name: 2,7-ditert-butyl-5,10-dihydroxy-10b,10c-dimethylpyrene-4,9-dione Traditional Name: 2,7-ditert-butyl-5,10-dihydroxy-10b,10c-dimethyl-pyrene-4,9-quinone Formula: C26H30O4 MolecularWeight: 406.514

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC(=CC1=C(C(=O)C4=CC(=CC(=C(C3=O)O)C24C)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC12C3=CC(=CC1=C(C(=O)C4=CC(=CC(=C(C3=O)O)C24C)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C26H30O4/c1-23(2,3)13-9-15-19(27)21(29)17-11-14(24(4,5)6)12-18-22(30)20(28)16(10-13)25(15,7)26(17,18)8/h9-12,27,30H,1-8H3