(E)-5-methyl-2-phenyl-oct-5-ene-4-sulfonic acid

Systemtic Name: (E)-5-methyl-2-phenyl-oct-5-ene-4-sulfonic acid Openeye Name: (E)-5-methyl-2-phenyl-oct-5-ene-4-sulfonic acid CAS Name: (E)-5-methyl-2-phenyl-5-octene-4-sulfonic acid IUPAC Name: (E)-5-methyl-2-phenyloct-5-ene-4-sulfonic acid Traditional Name: (E)-5-methyl-2-phenyl-oct-5-ene-4-sulfonic acid Formula: C15H22O3S MolecularWeight: 282.39838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C)C(CC(C)C1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CC/C=C(\C)/C(CC(C)C1=CC=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C15H22O3S/c1-4-8-12(2)15(19(16,17)18)11-13(3)14-9-6-5-7-10-14/h5-10,13,15H,4,11H2,1-3H3,(H,16,17,18)/b12-8+