9-oxidanylidene-5-propanoyl-7-propan-2-yloxy-xanthene-2-carboxylic acid

Systemtic Name: 9-oxidanylidene-5-propanoyl-7-propan-2-yloxy-xanthene-2-carboxylic acid Openeye Name: 7-isopropoxy-9-oxo-5-propanoyl-xanthene-2-carboxylic acid CAS Name: 9-oxo-5-(1-oxopropyl)-7-propan-2-yloxy-2-xanthenecarboxylic acid IUPAC Name: 9-oxo-5-propanoyl-7-propan-2-yloxyxanthene-2-carboxylic acid Traditional Name: 7-isopropoxy-9-keto-5-propionyl-xanthene-2-carboxylic acid Formula: C20H18O6 MolecularWeight: 354.35332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C2C(=CC(=C1)OC(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCC(=O)C1=C2C(=CC(=C1)OC(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C20H18O6/c1-4-16(21)13-8-12(25-10(2)3)9-15-18(22)14-7-11(20(23)24)5-6-17(14)26-19(13)15/h5-10H,4H2,1-3H3,(H,23,24)