2-bromanylbenzene-1,3,5-trisulfonic acid

Systemtic Name: 2-bromanylbenzene-1,3,5-trisulfonic acid Openeye Name: 2-bromobenzene-1,3,5-trisulfonic acid CAS Name: 2-bromobenzene-1,3,5-trisulfonic acid IUPAC Name: 2-bromobenzene-1,3,5-trisulfonic acid Traditional Name: 2-bromobenzene-1,3,5-trisulfonic acid Formula: C6H5BrO9S3 MolecularWeight: 397.1975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)O)Br)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)O)Br)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C6H5BrO9S3/c7-6-4(18(11,12)13)1-3(17(8,9)10)2-5(6)19(14,15)16/h1-2H,(H,8,9,10)(H,11,12,13)(H,14,15,16)