benzene-1,2,4-tricarboxylic acid; propane-1,2,3-triol

Systemtic Name: benzene-1,2,4-tricarboxylic acid; propane-1,2,3-triol Openeye Name: benzene-1,2,4-tricarboxylic acid; glycerol CAS Name: benzene-1,2,4-tricarboxylic acid; propane-1,2,3-triol IUPAC Name: benzene-1,2,4-tricarboxylic acid; propane-1,2,3-triol Traditional Name: glycerol; trimellitic acid Formula: C12H14O9 MolecularWeight: 302.23416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6O6.C3H8O3/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;4-1-3(6)2-5/h1-3H,(H,10,11)(H,12,13)(H,14,15);3-6H,1-2H2