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

Systemtic Name: (4-chlorophenyl) 5-(1,2-oxazol-5-yl)thiophene-2-sulfonate Openeye Name: (4-chlorophenyl) 5-isoxazol-5-ylthiophene-2-sulfonate CAS Name: 5-(5-isoxazolyl)-2-thiophenesulfonic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 5-(1,2-oxazol-5-yl)thiophene-2-sulfonate Traditional Name: 5-isoxazol-5-ylthiophene-2-sulfonic acid (4-chlorophenyl) ester Formula: C13H8ClNO4S2 MolecularWeight: 341.78992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OS(=O)(=O)C2=CC=C(S2)C3=CC=NO3)Cl

Isomeric SMILES

C1=CC(=CC=C1OS(=O)(=O)C2=CC=C(S2)C3=CC=NO3)Cl

InChI

InChI=1S/C13H8ClNO4S2/c14-9-1-3-10(4-2-9)19-21(16,17)13-6-5-12(20-13)11-7-8-15-18-11/h1-8H