1,4-bis(oxidanyl)-2-(1-oxidanylheptyl)anthracene-9,10-dione

Systemtic Name: 1,4-bis(oxidanyl)-2-(1-oxidanylheptyl)anthracene-9,10-dione Openeye Name: 1,4-dihydroxy-2-(1-hydroxyheptyl)anthracene-9,10-dione CAS Name: 1,4-dihydroxy-2-(1-hydroxyheptyl)anthracene-9,10-dione IUPAC Name: 1,4-dihydroxy-2-(1-hydroxyheptyl)anthracene-9,10-dione Traditional Name: 1,4-dihydroxy-2-(1-hydroxyheptyl)-9,10-anthraquinone Formula: C21H22O5 MolecularWeight: 354.39638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC(=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O)O

Isomeric SMILES

CCCCCCC(C1=CC(=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O)O

InChI

InChI=1S/C21H22O5/c1-2-3-4-5-10-15(22)14-11-16(23)17-18(21(14)26)20(25)13-9-7-6-8-12(13)19(17)24/h6-9,11,15,22-23,26H,2-5,10H2,1H3