2-[1,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]-3-phenyl-propanoic acid

Systemtic Name: 2-[1,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]-3-phenyl-propanoic acid Openeye Name: 2-(1,8-dihydroxy-9,10-dioxo-2-anthryl)-3-phenyl-propanoic acid CAS Name: 2-(1,8-dihydroxy-9,10-dioxo-2-anthracenyl)-3-phenylpropanoic acid IUPAC Name: 2-(1,8-dihydroxy-9,10-dioxoanthracen-2-yl)-3-phenylpropanoic acid Traditional Name: 2-(1,8-dihydroxy-9,10-diketo-2-anthryl)-3-phenyl-propionic acid Formula: C23H16O6 MolecularWeight: 388.36954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H16O6/c24-17-8-4-7-14-18(17)22(27)19-15(20(14)25)10-9-13(21(19)26)16(23(28)29)11-12-5-2-1-3-6-12/h1-10,16,24,26H,11H2,(H,28,29)