(2-bromanyl-4-cyano-6-ethoxy-phenyl) thiophene-2-sulfonate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) thiophene-2-sulfonate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) thiophene-2-sulfonate CAS Name: 2-thiophenesulfonic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) thiophene-2-sulfonate Traditional Name: thiophene-2-sulfonic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C13H10BrNO4S2 MolecularWeight: 388.2568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C13H10BrNO4S2/c1-2-18-11-7-9(8-15)6-10(14)13(11)19-21(16,17)12-4-3-5-20-12/h3-7H,2H2,1H3