[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(phenylsulfonylmethyl)furan-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(phenylsulfonylmethyl)furan-2-carboxylate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(benzenesulfonylmethyl)furan-2-carboxylate CAS Name: 3-(benzenesulfonylmethyl)-2-furancarboxylic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-(benzenesulfonylmethyl)furan-2-carboxylate Traditional Name: 3-(besylmethyl)furan-2-carboxylic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=C(C=CO1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCC=C)OC(=O)C1=C(C=CO1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO6S/c1-3-10-19-17(20)13(2)25-18(21)16-14(9-11-24-16)12-26(22,23)15-7-5-4-6-8-15/h3-9,11,13H,1,10,12H2,2H3,(H,19,20)