3-phenyl-2-[2,2,2-tris(chloranyl)ethoxycarbonylamino]propanoic acid

Systemtic Name: 3-phenyl-2-[2,2,2-tris(chloranyl)ethoxycarbonylamino]propanoic acid Openeye Name: 3-phenyl-2-(2,2,2-trichloroethoxycarbonylamino)propanoic acid CAS Name: 2-[[oxo(2,2,2-trichloroethoxy)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-2-(2,2,2-trichloroethoxycarbonylamino)propanoic acid Traditional Name: 3-phenyl-2-(2,2,2-trichloroethoxycarbonylamino)propionic acid Formula: C12H12Cl3NO4 MolecularWeight: 340.58698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C12H12Cl3NO4/c13-12(14,15)7-20-11(19)16-9(10(17)18)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,16,19)(H,17,18)