1,6-dipropoxyhexa-1,5-diyne-3-sulfonic acid

Systemtic Name: 1,6-dipropoxyhexa-1,5-diyne-3-sulfonic acid Openeye Name: 1,6-dipropoxyhexa-1,5-diyne-3-sulfonic acid CAS Name: 1,6-dipropoxy-3-hexa-1,5-diynesulfonic acid IUPAC Name: 1,6-dipropoxyhexa-1,5-diyne-3-sulfonic acid Traditional Name: 1,6-dipropoxyhexa-1,5-diyne-3-sulfonic acid Formula: C12H18O5S MolecularWeight: 274.33332

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC#CCC(C#COCCC)S(=O)(=O)O

Isomeric SMILES

CCCOC#CCC(C#COCCC)S(=O)(=O)O

InChI

InChI=1S/C12H18O5S/c1-3-8-16-10-5-6-12(18(13,14)15)7-11-17-9-4-2/h12H,3-4,6,8-9H2,1-2H3,(H,13,14,15)