[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-(4-acetamido-2-fluoro-phenyl)-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-(4-acetamido-2-fluoro-phenyl)-2-keto-ethyl] ester Formula: C20H19FN2O5 MolecularWeight: 386.373663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=C(C=C(C=C1)NC(=O)C)F)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)C1=C(C=C(C=C1)NC(=O)C)F)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H19FN2O5/c1-12(22-19(26)14-6-4-3-5-7-14)20(27)28-11-18(25)16-9-8-15(10-17(16)21)23-13(2)24/h3-10,12H,11H2,1-2H3,(H,22,26)(H,23,24)/t12-/m0/s1