2-methyl-4-[3-(3-methyl-3-sulfo-butyl)sulfinylpropylsulfinyl]butane-2-sulfonic acid

Systemtic Name: 2-methyl-4-[3-(3-methyl-3-sulfo-butyl)sulfinylpropylsulfinyl]butane-2-sulfonic acid Openeye Name: 2-methyl-4-[3-(3-methyl-3-sulfo-butyl)sulfinylpropylsulfinyl]butane-2-sulfonic acid CAS Name: 2-methyl-4-[3-(3-methyl-3-sulfobutyl)sulfinylpropylsulfinyl]-2-butanesulfonic acid IUPAC Name: 2-methyl-4-[3-(3-methyl-3-sulfobutyl)sulfinylpropylsulfinyl]butane-2-sulfonic acid Traditional Name: 2-methyl-4-[3-(3-methyl-3-sulfo-butyl)sulfinylpropylsulfinyl]butane-2-sulfonic acid Formula: C13H28O8S4 MolecularWeight: 440.61662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H28O8S4/c1-12(2,24(16,17)18)6-10-22(14)8-5-9-23(15)11-7-13(3,4)25(19,20)21/h5-11H2,1-4H3,(H,16,17,18)(H,19,20,21)