(4-chloranyl-3-ethyl-phenyl) thiophene-2-sulfonate

Systemtic Name: (4-chloranyl-3-ethyl-phenyl) thiophene-2-sulfonate Openeye Name: (4-chloro-3-ethyl-phenyl) thiophene-2-sulfonate CAS Name: 2-thiophenesulfonic acid (4-chloro-3-ethylphenyl) ester IUPAC Name: (4-chloro-3-ethylphenyl) thiophene-2-sulfonate Traditional Name: thiophene-2-sulfonic acid (4-chloro-3-ethyl-phenyl) ester Formula: C12H11ClO3S2 MolecularWeight: 302.79694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OS(=O)(=O)C2=CC=CS2)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OS(=O)(=O)C2=CC=CS2)Cl

InChI

InChI=1S/C12H11ClO3S2/c1-2-9-8-10(5-6-11(9)13)16-18(14,15)12-4-3-7-17-12/h3-8H,2H2,1H3