benzene-1,2,4-tricarboxylic acid; 6-methylheptan-1-ol

Systemtic Name: benzene-1,2,4-tricarboxylic acid; 6-methylheptan-1-ol Openeye Name: benzene-1,2,4-tricarboxylic acid; 6-methylheptan-1-ol CAS Name: benzene-1,2,4-tricarboxylic acid; 6-methyl-1-heptanol IUPAC Name: benzene-1,2,4-tricarboxylic acid; 6-methylheptan-1-ol Traditional Name: 6-methylheptan-1-ol; trimellitic acid Formula: C17H24O7 MolecularWeight: 340.36826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6O6.C8H18O/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;1-8(2)6-4-3-5-7-9/h1-3H,(H,10,11)(H,12,13)(H,14,15);8-9H,3-7H2,1-2H3