[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(4-fluorophenyl)imidazole-4-carboxylate

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(4-fluorophenyl)imidazole-4-carboxylate Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl] 3-(4-fluorophenyl)imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-4-imidazolecarboxylic acid [(2S)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl] 3-(4-fluorophenyl)imidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)imidazole-4-carboxylic acid [(1S)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C13H12FN3O3 MolecularWeight: 277.251083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CN=CN1C2=CC=C(C=C2)F

Isomeric SMILES

C[C@@H](C(=O)N)OC(=O)C1=CN=CN1C2=CC=C(C=C2)F

InChI

InChI=1S/C13H12FN3O3/c1-8(12(15)18)20-13(19)11-6-16-7-17(11)10-4-2-9(14)3-5-10/h2-8H,1H3,(H2,15,18)/t8-/m0/s1