8-bromanylnaphthalene-1,4,5-tricarboxylic acid

Systemtic Name: 8-bromanylnaphthalene-1,4,5-tricarboxylic acid Openeye Name: 8-bromonaphthalene-1,4,5-tricarboxylic acid CAS Name: 8-bromonaphthalene-1,4,5-tricarboxylic acid IUPAC Name: 8-bromonaphthalene-1,4,5-tricarboxylic acid Traditional Name: 8-bromonaphthalene-1,4,5-tricarboxylic acid Formula: C13H7BrO6 MolecularWeight: 339.09508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=CC=C(C2=C1C(=O)O)C(=O)O)Br)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=CC=C(C2=C1C(=O)O)C(=O)O)Br)C(=O)O

InChI

InChI=1S/C13H7BrO6/c14-8-4-3-6(12(17)18)9-5(11(15)16)1-2-7(10(8)9)13(19)20/h1-4H,(H,15,16)(H,17,18)(H,19,20)