5,5,5-tris(fluoranyl)-4-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5,5,5-tris(fluoranyl)-4-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-5,5,5-trifluoro-4-oxo-pentanoic acid CAS Name: 5,5,5-trifluoro-4-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5,5,5-trifluoro-4-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-5,5,5-trifluoro-4-keto-valeric acid Formula: C13H12F3NO5 MolecularWeight: 319.23329

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H12F3NO5/c14-13(15,16)10(18)6-9(11(19)20)17-12(21)22-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,17,21)(H,19,20)