methyl 4-[[1,8-bis(oxidanyl)-9-oxidanylidene-10H-anthracen-2-yl]carbonyl]benzoate

Systemtic Name: methyl 4-[[1,8-bis(oxidanyl)-9-oxidanylidene-10H-anthracen-2-yl]carbonyl]benzoate Openeye Name: methyl 4-(1,8-dihydroxy-9-oxo-10H-anthracene-2-carbonyl)benzoate CAS Name: 4-[(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-(1,8-dihydroxy-9-oxo-10H-anthracene-2-carbonyl)benzoate Traditional Name: 4-(1,8-dihydroxy-9-keto-10H-anthracene-2-carbonyl)benzoic acid methyl ester Formula: C23H16O6 MolecularWeight: 388.36954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)C2=C(C3=C(CC4=C(C3=O)C(=CC=C4)O)C=C2)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)C2=C(C3=C(CC4=C(C3=O)C(=CC=C4)O)C=C2)O

InChI

InChI=1S/C23H16O6/c1-29-23(28)13-7-5-12(6-8-13)20(25)16-10-9-15-11-14-3-2-4-17(24)18(14)22(27)19(15)21(16)26/h2-10,24,26H,11H2,1H3