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

Systemtic Name: [2-[2-(2-methyl-3-oxidanyl-phenyl)-4,5-dihydro-1,3-oxazol-4-yl]-2-oxidanyl-ethyl] methanesulfonate Openeye Name: [2-hydroxy-2-[2-(3-hydroxy-2-methyl-phenyl)-4,5-dihydrooxazol-4-yl]ethyl] methanesulfonate CAS Name: methanesulfonic acid [2-hydroxy-2-[2-(3-hydroxy-2-methylphenyl)-4,5-dihydrooxazol-4-yl]ethyl] ester IUPAC Name: [2-hydroxy-2-[2-(3-hydroxy-2-methylphenyl)-4,5-dihydro-1,3-oxazol-4-yl]ethyl] methanesulfonate Traditional Name: methanesulfonic acid [2-hydroxy-2-[2-(3-hydroxy-2-methyl-phenyl)-2-oxazolin-4-yl]ethyl] ester Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C2=NC(CO2)C(COS(=O)(=O)C)O

Isomeric SMILES

CC1=C(C=CC=C1O)C2=NC(CO2)C(COS(=O)(=O)C)O

InChI

InChI=1S/C13H17NO6S/c1-8-9(4-3-5-11(8)15)13-14-10(6-19-13)12(16)7-20-21(2,17)18/h3-5,10,12,15-16H,6-7H2,1-2H3