4,6-bis(methylsulfonyloxy)naphthalene-1-sulfonic acid

Systemtic Name: 4,6-bis(methylsulfonyloxy)naphthalene-1-sulfonic acid Openeye Name: 4,6-bis(methylsulfonyloxy)naphthalene-1-sulfonic acid CAS Name: 4,6-bis(methylsulfonyloxy)-1-naphthalenesulfonic acid IUPAC Name: 4,6-bis(methylsulfonyloxy)naphthalene-1-sulfonic acid Traditional Name: 4,6-bis(methylsulfonyloxy)naphthalene-1-sulfonic acid Formula: C12H12O9S3 MolecularWeight: 396.41328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=CC(=C2C=C1)S(=O)(=O)O)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=CC(=C2C=C1)S(=O)(=O)O)OS(=O)(=O)C

InChI

InChI=1S/C12H12O9S3/c1-22(13,14)20-8-3-4-9-10(7-8)11(21-23(2,15)16)5-6-12(9)24(17,18)19/h3-7H,1-2H3,(H,17,18,19)