4-[3-(3,3-dimethyl-4-sulfo-butyl)sulfinylpropylsulfinyl]-2,2-dimethyl-butane-1-sulfonic acid

Systemtic Name: 4-[3-(3,3-dimethyl-4-sulfo-butyl)sulfinylpropylsulfinyl]-2,2-dimethyl-butane-1-sulfonic acid Openeye Name: 4-[3-(3,3-dimethyl-4-sulfo-butyl)sulfinylpropylsulfinyl]-2,2-dimethyl-butane-1-sulfonic acid CAS Name: 4-[3-(3,3-dimethyl-4-sulfobutyl)sulfinylpropylsulfinyl]-2,2-dimethyl-1-butanesulfonic acid IUPAC Name: 4-[3-(3,3-dimethyl-4-sulfobutyl)sulfinylpropylsulfinyl]-2,2-dimethylbutane-1-sulfonic acid Traditional Name: 4-[3-(3,3-dimethyl-4-sulfo-butyl)sulfinylpropylsulfinyl]-2,2-dimethyl-butane-1-sulfonic acid Formula: C15H32O8S4 MolecularWeight: 468.66978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H32O8S4/c1-14(2,12-26(18,19)20)6-10-24(16)8-5-9-25(17)11-7-15(3,4)13-27(21,22)23/h5-13H2,1-4H3,(H,18,19,20)(H,21,22,23)