3,6-dimethyloct-4-yne-2,7-disulfonic acid

Systemtic Name: 3,6-dimethyloct-4-yne-2,7-disulfonic acid Openeye Name: 3,6-dimethyloct-4-yne-2,7-disulfonic acid CAS Name: 3,6-dimethyl-4-octyne-2,7-disulfonic acid IUPAC Name: 3,6-dimethyloct-4-yne-2,7-disulfonic acid Traditional Name: 3,6-dimethyloct-4-yne-2,7-disulfonic acid Formula: C10H18O6S2 MolecularWeight: 298.37632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H18O6S2/c1-7(9(3)17(11,12)13)5-6-8(2)10(4)18(14,15)16/h7-10H,1-4H3,(H,11,12,13)(H,14,15,16)