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

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H14ClFN2O4 MolecularWeight: 316.712663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClFN2O4/c1-7(2)16-13(20)17-11(18)6-21-12(19)9-4-3-8(14)5-10(9)15/h3-5,7H,6H2,1-2H3,(H2,16,17,18,20)