3-oxidanyl-4-oxidanylidene-henicosane-3-sulfonic acid

Systemtic Name: 3-oxidanyl-4-oxidanylidene-henicosane-3-sulfonic acid Openeye Name: 3-hydroxy-4-oxo-henicosane-3-sulfonic acid CAS Name: 3-hydroxy-4-oxo-3-heneicosanesulfonic acid IUPAC Name: 3-hydroxy-4-oxohenicosane-3-sulfonic acid Traditional Name: 3-hydroxy-4-keto-heneicosane-3-sulfonic acid Formula: C21H42O5S MolecularWeight: 406.62018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H42O5S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(23,4-2)27(24,25)26/h23H,3-19H2,1-2H3,(H,24,25,26)