tert-butyl 5-fluoranyl-4-oxidanyl-3-[2-(phenylcarbamoyloxy)propanoylamino]pentanoate

Systemtic Name: tert-butyl 5-fluoranyl-4-oxidanyl-3-[2-(phenylcarbamoyloxy)propanoylamino]pentanoate Openeye Name: tert-butyl 5-fluoro-4-hydroxy-3-[2-(phenylcarbamoyloxy)propanoylamino]pentanoate CAS Name: 3-[[2-[anilino(oxo)methoxy]-1-oxopropyl]amino]-5-fluoro-4-hydroxypentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-fluoro-4-hydroxy-3-[2-(phenylcarbamoyloxy)propanoylamino]pentanoate Traditional Name: 5-fluoro-4-hydroxy-3-[2-(phenylcarbamoyloxy)propanoylamino]valeric acid tert-butyl ester Formula: C19H27FN2O6 MolecularWeight: 398.425883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)OC(C)(C)C)C(CF)O)OC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NC(CC(=O)OC(C)(C)C)C(CF)O)OC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C19H27FN2O6/c1-12(27-18(26)21-13-8-6-5-7-9-13)17(25)22-14(15(23)11-20)10-16(24)28-19(2,3)4/h5-9,12,14-15,23H,10-11H2,1-4H3,(H,21,26)(H,22,25)