benzene-1,2,4-tricarboxylic acid; 3-methylpentane-1,5-diol

Systemtic Name: benzene-1,2,4-tricarboxylic acid; 3-methylpentane-1,5-diol Openeye Name: benzene-1,2,4-tricarboxylic acid; 3-methylpentane-1,5-diol CAS Name: benzene-1,2,4-tricarboxylic acid; 3-methylpentane-1,5-diol IUPAC Name: benzene-1,2,4-tricarboxylic acid; 3-methylpentane-1,5-diol Traditional Name: 3-methylpentane-1,5-diol; trimellitic acid Formula: C15H20O8 MolecularWeight: 328.3145

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6O6.C6H14O2/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;1-6(2-4-7)3-5-8/h1-3H,(H,10,11)(H,12,13)(H,14,15);6-8H,2-5H2,1H3