disodium 2,2-dimethyl-3-(2-sulfoethyl)hexanedioate

Systemtic Name: disodium 2,2-dimethyl-3-(2-sulfoethyl)hexanedioate Openeye Name: disodium 2,2-dimethyl-3-(2-sulfoethyl)hexanedioate CAS Name: disodium 2,2-dimethyl-3-(2-sulfoethyl)hexanedioate IUPAC Name: disodium 2,2-dimethyl-3-(2-sulfoethyl)hexanedioate Traditional Name: disodium 2,2-dimethyl-3-(2-sulfoethyl)adipate Formula: C10H16Na2O7S MolecularWeight: 326.27438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCC(=O)[O-])CCS(=O)(=O)O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC(C)(C(CCC(=O)[O-])CCS(=O)(=O)O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C10H18O7S.2Na/c1-10(2,9(13)14)7(3-4-8(11)12)5-6-18(15,16)17;;/h7H,3-6H2,1-2H3,(H,11,12)(H,13,14)(H,15,16,17);;/q;2*+1/p-2