11-butyl-2,7-bis(oxidanyl)benzo[b]triphenylene-9,14-dione

Systemtic Name: 11-butyl-2,7-bis(oxidanyl)benzo[b]triphenylene-9,14-dione Openeye Name: 11-butyl-2,7-dihydroxy-benzo[b]triphenylene-9,14-dione CAS Name: 11-butyl-2,7-dihydroxybenzo[b]triphenylene-9,14-dione IUPAC Name: 11-butyl-2,7-dihydroxybenzo[b]triphenylene-9,14-dione Traditional Name: 11-butyl-2,7-dihydroxy-benzo[b]triphenylene-9,14-quinone Formula: C26H20O4 MolecularWeight: 396.4346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)C(=O)C3=C4C=C(C=CC4=C5C=CC(=CC5=C3C2=O)O)O

Isomeric SMILES

CCCCC1=CC2=C(C=C1)C(=O)C3=C4C=C(C=CC4=C5C=CC(=CC5=C3C2=O)O)O

InChI

InChI=1S/C26H20O4/c1-2-3-4-14-5-8-19-22(11-14)26(30)24-21-13-16(28)7-10-18(21)17-9-6-15(27)12-20(17)23(24)25(19)29/h5-13,27-28H,2-4H2,1H3