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

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 3-(phenylsulfonylmethyl)furan-2-carboxylate Openeye Name: [2-(isopropylamino)-1-methyl-2-oxo-ethyl] 3-(benzenesulfonylmethyl)furan-2-carboxylate CAS Name: 3-(benzenesulfonylmethyl)-2-furancarboxylic acid [1-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propan-2-ylamino)propan-2-yl] 3-(benzenesulfonylmethyl)furan-2-carboxylate Traditional Name: 3-(besylmethyl)furan-2-carboxylic acid [2-(isopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO6S/c1-12(2)19-17(20)13(3)25-18(21)16-14(9-10-24-16)11-26(22,23)15-7-5-4-6-8-15/h4-10,12-13H,11H2,1-3H3,(H,19,20)