(2Z)-3,7-dimethyl-1-oxidanyl-octa-2,6-diene-1-sulfonic acid

Systemtic Name: (2Z)-3,7-dimethyl-1-oxidanyl-octa-2,6-diene-1-sulfonic acid Openeye Name: (2Z)-1-hydroxy-3,7-dimethyl-octa-2,6-diene-1-sulfonic acid CAS Name: (2Z)-1-hydroxy-3,7-dimethyl-1-octa-2,6-dienesulfonic acid IUPAC Name: (2Z)-1-hydroxy-3,7-dimethylocta-2,6-diene-1-sulfonic acid Traditional Name: (2Z)-1-hydroxy-3,7-dimethyl-octa-2,6-diene-1-sulfonic acid Formula: C10H18O4S MolecularWeight: 234.31252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC(O)S(=O)(=O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C\C(O)S(=O)(=O)O)/C)C

InChI

InChI=1S/C10H18O4S/c1-8(2)5-4-6-9(3)7-10(11)15(12,13)14/h5,7,10-11H,4,6H2,1-3H3,(H,12,13,14)/b9-7-