(3-methyl-1,2-oxazol-5-yl)methyl 3-(methylsulfonylmethyl)benzoate

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)methyl 3-(methylsulfonylmethyl)benzoate Openeye Name: (3-methylisoxazol-5-yl)methyl 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid (3-methyl-5-isoxazolyl)methyl ester IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methyl 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid (3-methylisoxazol-5-yl)methyl ester Formula: C14H15NO5S MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)COC(=O)C2=CC(=CC=C2)CS(=O)(=O)C

Isomeric SMILES

CC1=NOC(=C1)COC(=O)C2=CC(=CC=C2)CS(=O)(=O)C

InChI

InChI=1S/C14H15NO5S/c1-10-6-13(20-15-10)8-19-14(16)12-5-3-4-11(7-12)9-21(2,17)18/h3-7H,8-9H2,1-2H3