benzene-1,2,4-tricarboxylic acid; phenol

Systemtic Name: benzene-1,2,4-tricarboxylic acid; phenol Openeye Name: benzene-1,2,4-tricarboxylic acid; phenol CAS Name: benzene-1,2,4-tricarboxylic acid; phenol IUPAC Name: benzene-1,2,4-tricarboxylic acid; phenol Traditional Name: phenol; trimellitic acid Formula: C30H24O14 MolecularWeight: 608.50316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C9H6O6.2C6H6O/c2*10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;2*7-6-4-2-1-3-5-6/h2*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1-5,7H