(4-cyanophenyl) 5-(1,2-oxazol-3-yl)thiophene-2-sulfonate

Systemtic Name: (4-cyanophenyl) 5-(1,2-oxazol-3-yl)thiophene-2-sulfonate Openeye Name: (4-cyanophenyl) 5-isoxazol-3-ylthiophene-2-sulfonate CAS Name: 5-(3-isoxazolyl)-2-thiophenesulfonic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 5-(1,2-oxazol-3-yl)thiophene-2-sulfonate Traditional Name: 5-isoxazol-3-ylthiophene-2-sulfonic acid (4-cyanophenyl) ester Formula: C14H8N2O4S2 MolecularWeight: 332.35432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OS(=O)(=O)C2=CC=C(S2)C3=NOC=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)OS(=O)(=O)C2=CC=C(S2)C3=NOC=C3

InChI

InChI=1S/C14H8N2O4S2/c15-9-10-1-3-11(4-2-10)20-22(17,18)14-6-5-13(21-14)12-7-8-19-16-12/h1-8H