2-tert-butyl-2-sulfo-butanedioic acid

Systemtic Name: 2-tert-butyl-2-sulfo-butanedioic acid Openeye Name: 2-tert-butyl-2-sulfo-butanedioic acid CAS Name: 2-tert-butyl-2-sulfobutanedioic acid IUPAC Name: 2-tert-butyl-2-sulfobutanedioic acid Traditional Name: 2-tert-butyl-2-sulfo-succinic acid Formula: C8H14O7S MolecularWeight: 254.25756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(=O)O)(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(C)(C)C(CC(=O)O)(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H14O7S/c1-7(2,3)8(6(11)12,4-5(9)10)16(13,14)15/h4H2,1-3H3,(H,9,10)(H,11,12)(H,13,14,15)