(1R,2R)-1-methyl-7-oxidanyl-9,10-bis(oxidanylidene)-2-(3-oxidanylidenebutyl)-2H-anthracene-1-carbaldehyde

Systemtic Name: (1R,2R)-1-methyl-7-oxidanyl-9,10-bis(oxidanylidene)-2-(3-oxidanylidenebutyl)-2H-anthracene-1-carbaldehyde Openeye Name: (1R,2R)-7-hydroxy-1-methyl-9,10-dioxo-2-(3-oxobutyl)-2H-anthracene-1-carbaldehyde CAS Name: (1R,2R)-7-hydroxy-1-methyl-9,10-dioxo-2-(3-oxobutyl)-2H-anthracene-1-carboxaldehyde IUPAC Name: (1R,2R)-7-hydroxy-1-methyl-9,10-dioxo-2-(3-oxobutyl)-2H-anthracene-1-carbaldehyde Traditional Name: (1R,2R)-7-hydroxy-9,10-diketo-2-(3-ketobutyl)-1-methyl-2H-anthracene-1-carbaldehyde Formula: C20H18O5 MolecularWeight: 338.35392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C=CC2=C(C1(C)C=O)C(=O)C3=C(C2=O)C=CC(=C3)O

Isomeric SMILES

CC(=O)CC[C@@H]1C=CC2=C([C@]1(C)C=O)C(=O)C3=C(C2=O)C=CC(=C3)O

InChI

InChI=1S/C20H18O5/c1-11(22)3-4-12-5-7-15-17(20(12,2)10-21)19(25)16-9-13(23)6-8-14(16)18(15)24/h5-10,12,23H,3-4H2,1-2H3/t12-,20-/m1/s1