[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-(methylsulfonylmethyl)benzoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO5S/c1-4-9-16-14(17)11(2)21-15(18)13-7-5-12(6-8-13)10-22(3,19)20/h4-8,11H,1,9-10H2,2-3H3,(H,16,17)/t11-/m1/s1