7-chloranyl-2-(4-octoxyphenyl)-1,5-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 7-chloranyl-2-(4-octoxyphenyl)-1,5-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 7-chloro-1,5-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione CAS Name: 7-chloro-1,5-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione IUPAC Name: 7-chloro-1,5-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione Traditional Name: 7-chloro-1,5-dihydroxy-2-(4-octoxyphenyl)-9,10-anthraquinone Formula: C28H27ClO5 MolecularWeight: 478.96398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C3=C(C=C2)C(=O)C4=C(C=C(C=C4C3=O)Cl)O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C3=C(C=C2)C(=O)C4=C(C=C(C=C4C3=O)Cl)O)O

InChI

InChI=1S/C28H27ClO5/c1-2-3-4-5-6-7-14-34-19-10-8-17(9-11-19)20-12-13-21-25(26(20)31)28(33)22-15-18(29)16-23(30)24(22)27(21)32/h8-13,15-16,30-31H,2-7,14H2,1H3