lithium 4,5-dimethyl-2-sulfo-benzene-1,3-dicarboxylic acid

Systemtic Name: lithium 4,5-dimethyl-2-sulfo-benzene-1,3-dicarboxylic acid Openeye Name: lithium 4,5-dimethyl-2-sulfo-benzene-1,3-dicarboxylic acid CAS Name: lithium 4,5-dimethyl-2-sulfobenzene-1,3-dicarboxylic acid IUPAC Name: lithium 4,5-dimethyl-2-sulfobenzene-1,3-dicarboxylic acid Traditional Name: lithium 4,5-dimethyl-2-sulfo-isophthalic acid Formula: C10H10LiO7S+ MolecularWeight: 281.1882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=C(C(=C(C(=C1)C(=O)O)S(=O)(=O)O)C(=O)O)C

Isomeric SMILES

[Li+].CC1=C(C(=C(C(=C1)C(=O)O)S(=O)(=O)O)C(=O)O)C

InChI

InChI=1S/C10H10O7S.Li/c1-4-3-6(9(11)12)8(18(15,16)17)7(5(4)2)10(13)14;/h3H,1-2H3,(H,11,12)(H,13,14)(H,15,16,17);/q;+1