[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(methylsulfonylmethyl)benzoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(methylsulfonylmethyl)benzoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid [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(=CC=C1)CS(=O)(=O)C

Isomeric SMILES

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

InChI

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