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

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-methylsulfonylbenzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C16H13NO5S2 MolecularWeight: 363.40812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NOC(=C2)C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NOC(=C2)C3=CC=CS3

InChI

InChI=1S/C16H13NO5S2/c1-24(19,20)15-7-3-2-5-12(15)16(18)21-10-11-9-13(22-17-11)14-6-4-8-23-14/h2-9H,10H2,1H3