2,2-bis(2-methylpropyl)-3-sulfo-butanedioic acid

Systemtic Name: 2,2-bis(2-methylpropyl)-3-sulfo-butanedioic acid Openeye Name: 2,2-diisobutyl-3-sulfo-butanedioic acid CAS Name: 2,2-bis(2-methylpropyl)-3-sulfobutanedioic acid IUPAC Name: 2,2-bis(2-methylpropyl)-3-sulfobutanedioic acid Traditional Name: 2,2-diisobutyl-3-sulfo-succinic acid Formula: C12H22O7S MolecularWeight: 310.36388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O7S/c1-7(2)5-12(11(15)16,6-8(3)4)9(10(13)14)20(17,18)19/h7-9H,5-6H2,1-4H3,(H,13,14)(H,15,16)(H,17,18,19)