3-methyliminocyclohexa-1,5-diene-1-sulfonic acid

Systemtic Name: 3-methyliminocyclohexa-1,5-diene-1-sulfonic acid Openeye Name: 3-methyliminocyclohexa-1,5-diene-1-sulfonic acid CAS Name: 3-methylimino-1-cyclohexa-1,5-dienesulfonic acid IUPAC Name: 3-methyliminocyclohexa-1,5-diene-1-sulfonic acid Traditional Name: 3-methyliminocyclohexa-1,5-diene-1-sulfonic acid Formula: C7H9NO3S MolecularWeight: 187.21626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C1CC=CC(=C1)S(=O)(=O)O

Isomeric SMILES

CN=C1CC=CC(=C1)S(=O)(=O)O

InChI

InChI=1S/C7H9NO3S/c1-8-6-3-2-4-7(5-6)12(9,10)11/h2,4-5H,3H2,1H3,(H,9,10,11)