1,3-dimethylbenzene sulfate

Systemtic Name: 1,3-dimethylbenzene sulfate Openeye Name: m-xylene sulfate CAS Name: 1,3-xylene sulfate IUPAC Name: 1,3-xylene sulfate Traditional Name: m-xylene sulfate Formula: C8H10O4S-2 MolecularWeight: 202.2276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C8H10.H2O4S/c1-7-4-3-5-8(2)6-7;1-5(2,3)4/h3-6H,1-2H3;(H2,1,2,3,4)/p-2