[2-methyl-5-(4-methylsulfonylphenyl)-4,5-dihydro-1,3-oxazol-4-yl]methyl methanesulfonate

Systemtic Name: [2-methyl-5-(4-methylsulfonylphenyl)-4,5-dihydro-1,3-oxazol-4-yl]methyl methanesulfonate Openeye Name: [2-methyl-5-(4-methylsulfonylphenyl)-4,5-dihydrooxazol-4-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [2-methyl-5-(4-methylsulfonylphenyl)-4,5-dihydrooxazol-4-yl]methyl ester IUPAC Name: [2-methyl-5-(4-methylsulfonylphenyl)-4,5-dihydro-1,3-oxazol-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-(4-mesylphenyl)-2-methyl-2-oxazolin-4-yl]methyl ester Formula: C13H17NO6S2 MolecularWeight: 347.40718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(O1)C2=CC=C(C=C2)S(=O)(=O)C)COS(=O)(=O)C

Isomeric SMILES

CC1=NC(C(O1)C2=CC=C(C=C2)S(=O)(=O)C)COS(=O)(=O)C

InChI

InChI=1S/C13H17NO6S2/c1-9-14-12(8-19-22(3,17)18)13(20-9)10-4-6-11(7-5-10)21(2,15)16/h4-7,12-13H,8H2,1-3H3