5-methoxy-9-oxidanylidene-7-(1-oxidanylpropyl)xanthene-2-carboxylic acid

Systemtic Name: 5-methoxy-9-oxidanylidene-7-(1-oxidanylpropyl)xanthene-2-carboxylic acid Openeye Name: 7-(1-hydroxypropyl)-5-methoxy-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-(1-hydroxypropyl)-5-methoxy-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-(1-hydroxypropyl)-5-methoxy-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-(1-hydroxypropyl)-9-keto-5-methoxy-xanthene-2-carboxylic acid Formula: C18H16O6 MolecularWeight: 328.31604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O6/c1-3-13(19)10-7-12-16(20)11-6-9(18(21)22)4-5-14(11)24-17(12)15(8-10)23-2/h4-8,13,19H,3H2,1-2H3,(H,21,22)