benzene-1,2,4-tricarboxylic acid; 2-(2-hydroxyethyloxy)ethanol

Systemtic Name: benzene-1,2,4-tricarboxylic acid; 2-(2-hydroxyethyloxy)ethanol Openeye Name: benzene-1,2,4-tricarboxylic acid; 2-(2-hydroxyethoxy)ethanol CAS Name: benzene-1,2,4-tricarboxylic acid; 2-(2-hydroxyethoxy)ethanol IUPAC Name: benzene-1,2,4-tricarboxylic acid; 2-(2-hydroxyethoxy)ethanol Traditional Name: 2-(2-hydroxyethoxy)ethanol; trimellitic acid Formula: C13H16O9 MolecularWeight: 316.26074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.C(COCCO)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.C(COCCO)O

InChI

InChI=1S/C9H6O6.C4H10O3/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;5-1-3-7-4-2-6/h1-3H,(H,10,11)(H,12,13)(H,14,15);5-6H,1-4H2