(phenylmethyl) 5-azanyl-5-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate

Systemtic Name: (phenylmethyl) 5-azanyl-5-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanoate Openeye Name: benzyl 5-amino-5-oxo-2-[(2,2,2-trifluoroacetyl)amino]pentanoate CAS Name: 5-amino-5-oxo-2-[(2,2,2-trifluoro-1-oxoethyl)amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-amino-5-oxo-2-[(2,2,2-trifluoroacetyl)amino]pentanoate Traditional Name: 5-amino-5-keto-2-[(2,2,2-trifluoroacetyl)amino]valeric acid benzyl ester Formula: C14H15F3N2O4 MolecularWeight: 332.27511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15F3N2O4/c15-14(16,17)13(22)19-10(6-7-11(18)20)12(21)23-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,18,20)(H,19,22)