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

Systemtic Name: 3-[1,8-bis(oxidanyl)-9-oxidanylidene-10H-anthracen-2-yl]propanoic acid Openeye Name: 3-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)propanoic acid CAS Name: 3-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)propanoic acid IUPAC Name: 3-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)propanoic acid Traditional Name: 3-(1,8-dihydroxy-9-keto-10H-anthracen-2-yl)propionic acid Formula: C17H14O5 MolecularWeight: 298.29006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC(=C3O)CCC(=O)O

Isomeric SMILES

C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC(=C3O)CCC(=O)O

InChI

InChI=1S/C17H14O5/c18-12-3-1-2-10-8-11-5-4-9(6-7-13(19)20)16(21)15(11)17(22)14(10)12/h1-5,18,21H,6-8H2,(H,19,20)