[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-[bis(fluoranyl)methylsulfonyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-[bis(fluoranyl)methylsulfonyl]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-(difluoromethylsulfonyl)benzoate CAS Name: 4-(difluoromethylsulfonyl)benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-(difluoromethylsulfonyl)benzoate Traditional Name: 4-(difluoromethylsulfonyl)benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C14H16F2N2O6S MolecularWeight: 378.348446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)C(F)F

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)C(F)F

InChI

InChI=1S/C14H16F2N2O6S/c1-8(2)17-14(21)18-11(19)7-24-12(20)9-3-5-10(6-4-9)25(22,23)13(15)16/h3-6,8,13H,7H2,1-2H3,(H2,17,18,19,21)