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

Systemtic Name: 2,3-bis(3-methylbutyl)-2-sulfo-butanedioic acid Openeye Name: 2,3-diisopentyl-2-sulfo-butanedioic acid CAS Name: 2,3-bis(3-methylbutyl)-2-sulfobutanedioic acid IUPAC Name: 2,3-bis(3-methylbutyl)-2-sulfobutanedioic acid Traditional Name: 2,3-diisoamyl-2-sulfo-succinic acid Formula: C14H26O7S MolecularWeight: 338.41704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H26O7S/c1-9(2)5-6-11(12(15)16)14(13(17)18,22(19,20)21)8-7-10(3)4/h9-11H,5-8H2,1-4H3,(H,15,16)(H,17,18)(H,19,20,21)