[(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 3-(methylsulfonylmethyl)benzoate

Systemtic Name: [(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 3-(methylsulfonylmethyl)benzoate Openeye Name: [(1R)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid [(1R)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl] ester Formula: C15H21NO6S MolecularWeight: 343.39534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC(=O)C1=CC(=CC=C1)CS(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)NCCOC)OC(=O)C1=CC(=CC=C1)CS(=O)(=O)C

InChI

InChI=1S/C15H21NO6S/c1-11(14(17)16-7-8-21-2)22-15(18)13-6-4-5-12(9-13)10-23(3,19)20/h4-6,9,11H,7-8,10H2,1-3H3,(H,16,17)/t11-/m1/s1