6-methyl-5-oxidanylidene-hept-6-ene-1-sulfonic acid

Systemtic Name: 6-methyl-5-oxidanylidene-hept-6-ene-1-sulfonic acid Openeye Name: 6-methyl-5-oxo-hept-6-ene-1-sulfonic acid CAS Name: 6-methyl-5-oxo-6-heptene-1-sulfonic acid IUPAC Name: 6-methyl-5-oxohept-6-ene-1-sulfonic acid Traditional Name: 5-keto-6-methyl-hept-6-ene-1-sulfonic acid Formula: C8H14O4S MolecularWeight: 206.25936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)CCCCS(=O)(=O)O

Isomeric SMILES

CC(=C)C(=O)CCCCS(=O)(=O)O

InChI

InChI=1S/C8H14O4S/c1-7(2)8(9)5-3-4-6-13(10,11)12/h1,3-6H2,2H3,(H,10,11,12)