(4-chlorophenyl) 3,5-dimethyl-1,2-oxazole-4-sulfonate

Systemtic Name: (4-chlorophenyl) 3,5-dimethyl-1,2-oxazole-4-sulfonate Openeye Name: (4-chlorophenyl) 3,5-dimethylisoxazole-4-sulfonate CAS Name: 3,5-dimethyl-4-isoxazolesulfonic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 3,5-dimethyl-1,2-oxazole-4-sulfonate Traditional Name: 3,5-dimethylisoxazole-4-sulfonic acid (4-chlorophenyl) ester Formula: C11H10ClNO4S MolecularWeight: 287.7194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H10ClNO4S/c1-7-11(8(2)16-13-7)18(14,15)17-10-5-3-9(12)4-6-10/h3-6H,1-2H3