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

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)methyl 3-methylsulfonylbenzoate Openeye Name: (3-methylisoxazol-5-yl)methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (3-methyl-5-isoxazolyl)methyl ester IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (3-methylisoxazol-5-yl)methyl ester Formula: C13H13NO5S MolecularWeight: 295.31102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO5S/c1-9-6-11(19-14-9)8-18-13(15)10-4-3-5-12(7-10)20(2,16)17/h3-7H,8H2,1-2H3