2-(4-methylsulfonylphenyl)-2-(3-phenyl-1,2-oxazol-5-yl)ethanoic acid

Systemtic Name: 2-(4-methylsulfonylphenyl)-2-(3-phenyl-1,2-oxazol-5-yl)ethanoic acid Openeye Name: 2-(4-methylsulfonylphenyl)-2-(3-phenylisoxazol-5-yl)acetic acid CAS Name: 2-(4-methylsulfonylphenyl)-2-(3-phenyl-5-isoxazolyl)acetic acid IUPAC Name: 2-(4-methylsulfonylphenyl)-2-(3-phenyl-1,2-oxazol-5-yl)acetic acid Traditional Name: 2-(4-mesylphenyl)-2-(3-phenylisoxazol-5-yl)acetic acid Formula: C18H15NO5S MolecularWeight: 357.3804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(C2=CC(=NO2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(C2=CC(=NO2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H15NO5S/c1-25(22,23)14-9-7-13(8-10-14)17(18(20)21)16-11-15(19-24-16)12-5-3-2-4-6-12/h2-11,17H,1H3,(H,20,21)