(3R)-3-(1,3-benzodioxol-5-yl)-3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate

Systemtic Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[2,2,2-tris(fluoranyl)ethanoylamino]propanoate Openeye Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(2,2,2-trifluoroacetyl)amino]propanoate CAS Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(2,2,2-trifluoro-1-oxoethyl)amino]propanoate IUPAC Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(2,2,2-trifluoroacetyl)amino]propanoate Traditional Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(2,2,2-trifluoroacetyl)amino]propionate Formula: C12H9F3NO5- MolecularWeight: 304.19877

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)[O-])NC(=O)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@@H](CC(=O)[O-])NC(=O)C(F)(F)F

InChI

InChI=1S/C12H10F3NO5/c13-12(14,15)11(19)16-7(4-10(17)18)6-1-2-8-9(3-6)21-5-20-8/h1-3,7H,4-5H2,(H,16,19)(H,17,18)/p-1/t7-/m1/s1