4-(5,6-dicarboxyoxy-1,3,3-trimethyl-2H-inden-1-yl)phthalic acid

Systemtic Name: 4-(5,6-dicarboxyoxy-1,3,3-trimethyl-2H-inden-1-yl)phthalic acid Openeye Name: 4-(5,6-dicarboxyoxy-1,3,3-trimethyl-indan-1-yl)phthalic acid CAS Name: 4-(5,6-dicarboxyoxy-1,3,3-trimethyl-2H-inden-1-yl)phthalic acid IUPAC Name: 4-(5,6-dicarboxyoxy-1,3,3-trimethyl-2H-inden-1-yl)phthalic acid Traditional Name: 4-(5,6-dicarboxyoxy-1,3,3-trimethyl-indan-1-yl)phthalic acid Formula: C22H20O10 MolecularWeight: 444.3882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=CC(=C(C=C21)OC(=O)O)OC(=O)O)(C)C3=CC(=C(C=C3)C(=O)O)C(=O)O)C

Isomeric SMILES

CC1(CC(C2=CC(=C(C=C21)OC(=O)O)OC(=O)O)(C)C3=CC(=C(C=C3)C(=O)O)C(=O)O)C

InChI

InChI=1S/C22H20O10/c1-21(2)9-22(3,10-4-5-11(17(23)24)12(6-10)18(25)26)14-8-16(32-20(29)30)15(7-13(14)21)31-19(27)28/h4-8H,9H2,1-3H3,(H,23,24)(H,25,26)(H,27,28)(H,29,30)