sodium 2,4,6-tris(chloranyl)-5-sulfo-benzene-1,3-dicarboxylate

Systemtic Name: sodium 2,4,6-tris(chloranyl)-5-sulfo-benzene-1,3-dicarboxylate Openeye Name: sodium 2,4,6-trichloro-5-sulfo-benzene-1,3-dicarboxylate CAS Name: sodium 2,4,6-trichloro-5-sulfobenzene-1,3-dicarboxylate IUPAC Name: sodium 2,4,6-trichloro-5-sulfobenzene-1,3-dicarboxylate Traditional Name: sodium 2,4,6-trichloro-5-sulfo-isophthalate Formula: C8HCl3NaO7S- MolecularWeight: 370.50311

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1Cl)S(=O)(=O)O)Cl)C(=O)[O-])Cl)C(=O)[O-].[Na+]

Isomeric SMILES

C1(=C(C(=C(C(=C1Cl)S(=O)(=O)O)Cl)C(=O)[O-])Cl)C(=O)[O-].[Na+]

InChI

InChI=1S/C8H3Cl3O7S.Na/c9-3-1(7(12)13)4(10)6(19(16,17)18)5(11)2(3)8(14)15;/h(H,12,13)(H,14,15)(H,16,17,18);/q;+1/p-2