[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-4-fluoranyl-benzoate

Systemtic Name: [(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-4-fluoranyl-benzoate Openeye Name: [(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 2-amino-4-fluoro-benzoate CAS Name: 2-amino-4-fluorobenzoic acid [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] 2-amino-4-fluorobenzoate Traditional Name: 2-amino-4-fluoro-benzoic acid [(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H19FN2O3 MolecularWeight: 282.310663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C1=C(C=C(C=C1)F)N

Isomeric SMILES

C[C@@H](C(=O)NC(C)(C)C)OC(=O)C1=C(C=C(C=C1)F)N

InChI

InChI=1S/C14H19FN2O3/c1-8(12(18)17-14(2,3)4)20-13(19)10-6-5-9(15)7-11(10)16/h5-8H,16H2,1-4H3,(H,17,18)/t8-/m0/s1