2-(2-methylpropyl)-2-sulfo-butanedioic acid

Systemtic Name: 2-(2-methylpropyl)-2-sulfo-butanedioic acid Openeye Name: 2-isobutyl-2-sulfo-butanedioic acid CAS Name: 2-(2-methylpropyl)-2-sulfobutanedioic acid IUPAC Name: 2-(2-methylpropyl)-2-sulfobutanedioic acid Traditional Name: 2-isobutyl-2-sulfo-succinic acid Formula: C8H14O7S MolecularWeight: 254.25756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H14O7S/c1-5(2)3-8(7(11)12,4-6(9)10)16(13,14)15/h5H,3-4H2,1-2H3,(H,9,10)(H,11,12)(H,13,14,15)