2-dimethoxyphosphorylsulfanyl-6-methyl-1,3,8-tris(oxidanyl)anthracene-9,10-dione

Systemtic Name: 2-dimethoxyphosphorylsulfanyl-6-methyl-1,3,8-tris(oxidanyl)anthracene-9,10-dione Openeye Name: 2-dimethoxyphosphorylsulfanyl-1,3,8-trihydroxy-6-methyl-anthracene-9,10-dione CAS Name: 2-(dimethoxyphosphorylthio)-1,3,8-trihydroxy-6-methylanthracene-9,10-dione IUPAC Name: 2-dimethoxyphosphorylsulfanyl-1,3,8-trihydroxy-6-methylanthracene-9,10-dione Traditional Name: 2-(dimethoxyphosphorylthio)-1,3,8-trihydroxy-6-methyl-9,10-anthraquinone Formula: C17H15O8PS MolecularWeight: 410.334961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)SP(=O)(OC)OC)O)O

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)SP(=O)(OC)OC)O)O

InChI

InChI=1S/C17H15O8PS/c1-7-4-8-12(10(18)5-7)15(21)13-9(14(8)20)6-11(19)17(16(13)22)27-26(23,24-2)25-3/h4-6,18-19,22H,1-3H3