[(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [(1S)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [(1S)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl] ester Formula: C13H15ClFNO4 MolecularWeight: 303.713903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC(=O)C1=C(C=C(C=C1)Cl)F

Isomeric SMILES

C[C@@H](C(=O)NCCOC)OC(=O)C1=C(C=C(C=C1)Cl)F

InChI

InChI=1S/C13H15ClFNO4/c1-8(12(17)16-5-6-19-2)20-13(18)10-4-3-9(14)7-11(10)15/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)/t8-/m0/s1