7-methylbicyclo[4.2.0]octa-1(6),2,4-triene-2-sulfonic acid

Systemtic Name: 7-methylbicyclo[4.2.0]octa-1(6),2,4-triene-2-sulfonic acid Openeye Name: 7-methylbicyclo[4.2.0]octa-1(6),2,4-triene-2-sulfonic acid CAS Name: 7-methyl-2-bicyclo[4.2.0]octa-1(6),2,4-trienesulfonic acid IUPAC Name: 7-methylbicyclo[4.2.0]octa-1(6),2,4-triene-2-sulfonic acid Traditional Name: 7-methylbicyclo[4.2.0]octa-1(6),2,4-triene-2-sulfonic acid Formula: C9H10O3S MolecularWeight: 198.2389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C1C=CC=C2S(=O)(=O)O

Isomeric SMILES

CC1CC2=C1C=CC=C2S(=O)(=O)O

InChI

InChI=1S/C9H10O3S/c1-6-5-8-7(6)3-2-4-9(8)13(10,11)12/h2-4,6H,5H2,1H3,(H,10,11,12)