[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-methylsulfonylbenzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-methylsulfonylbenzoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H17NO5S MolecularWeight: 311.35348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=CC=CC=C1S(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)NCC=C)OC(=O)C1=CC=CC=C1S(=O)(=O)C

InChI

InChI=1S/C14H17NO5S/c1-4-9-15-13(16)10(2)20-14(17)11-7-5-6-8-12(11)21(3,18)19/h4-8,10H,1,9H2,2-3H3,(H,15,16)/t10-/m1/s1