sodium 4,6-dimethyl-2-sulfo-benzene-5-ide-1,3-dicarboxylic acid

Systemtic Name: sodium 4,6-dimethyl-2-sulfo-benzene-5-ide-1,3-dicarboxylic acid Openeye Name: sodium 4,6-dimethyl-2-sulfo-benzene-5-ide-1,3-dicarboxylic acid CAS Name: sodium 4,6-dimethyl-2-sulfobenzene-5-ide-1,3-dicarboxylic acid IUPAC Name: sodium 4,6-dimethyl-2-sulfobenzene-5-ide-1,3-dicarboxylic acid Traditional Name: sodium 4,6-dimethyl-2-sulfo-benzene-5-ide-1,3-dicarboxylic acid Formula: C10H9NaO7S MolecularWeight: 296.22903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(=C(C(=C1C(=O)O)S(=O)(=O)O)C(=O)O)C.[Na+]

Isomeric SMILES

CC1=[C-]C(=C(C(=C1C(=O)O)S(=O)(=O)O)C(=O)O)C.[Na+]

InChI

InChI=1S/C10H9O7S.Na/c1-4-3-5(2)7(10(13)14)8(18(15,16)17)6(4)9(11)12;/h1-2H3,(H,11,12)(H,13,14)(H,15,16,17);/q-1;+1