(3S)-3-(4-methoxyphenyl)-3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate

Systemtic Name: (3S)-3-(4-methoxyphenyl)-3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate Openeye Name: (3S)-3-(4-methoxyphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoate CAS Name: (3S)-3-(4-methoxyphenyl)-3-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoate IUPAC Name: (3S)-3-(4-methoxyphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoate Traditional Name: (3S)-3-(4-methoxyphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propionate Formula: C12H11F3NO4- MolecularWeight: 290.21525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CC(=O)[O-])NC(=O)C(F)(F)F

InChI

InChI=1S/C12H12F3NO4/c1-20-8-4-2-7(3-5-8)9(6-10(17)18)16-11(19)12(13,14)15/h2-5,9H,6H2,1H3,(H,16,19)(H,17,18)/p-1/t9-/m0/s1