2-[[10-(2-carboxy-3-oxidanyl-3-oxidanylidene-propyl)anthracen-9-yl]methyl]propanedioic acid

Systemtic Name: 2-[[10-(2-carboxy-3-oxidanyl-3-oxidanylidene-propyl)anthracen-9-yl]methyl]propanedioic acid Openeye Name: 2-[[10-(2-carboxy-3-hydroxy-3-oxo-propyl)-9-anthryl]methyl]propanedioic acid CAS Name: 2-[[10-(2-carboxy-3-hydroxy-3-oxopropyl)-9-anthracenyl]methyl]propanedioic acid IUPAC Name: 2-[[10-(2-carboxy-3-hydroxy-3-oxopropyl)anthracen-9-yl]methyl]propanedioic acid Traditional Name: 2-[[10-(2-carboxy-3-hydroxy-3-keto-propyl)-9-anthryl]methyl]malonic acid Formula: C22H18O8 MolecularWeight: 410.37352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CC(C(=O)O)C(=O)O)CC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CC(C(=O)O)C(=O)O)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C22H18O8/c23-19(24)17(20(25)26)9-15-11-5-1-2-6-12(11)16(10-18(21(27)28)22(29)30)14-8-4-3-7-13(14)15/h1-8,17-18H,9-10H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)