(5-phenyl-1,2-oxazol-3-yl)methyl 3-methylsulfonylbenzoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-methylsulfonylbenzoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C18H15NO5S MolecularWeight: 357.3804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=NOC(=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=NOC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO5S/c1-25(21,22)16-9-5-8-14(10-16)18(20)23-12-15-11-17(24-19-15)13-6-3-2-4-7-13/h2-11H,12H2,1H3