[3-oxidanylidene-1-[2,2,2-tris(chloranyl)ethoxycarbonylamino]butyl]phosphonic acid

Systemtic Name: [3-oxidanylidene-1-[2,2,2-tris(chloranyl)ethoxycarbonylamino]butyl]phosphonic acid Openeye Name: [3-oxo-1-(2,2,2-trichloroethoxycarbonylamino)butyl]phosphonic acid CAS Name: [3-oxo-1-[[oxo(2,2,2-trichloroethoxy)methyl]amino]butyl]phosphonic acid IUPAC Name: [3-oxo-1-(2,2,2-trichloroethoxycarbonylamino)butyl]phosphonic acid Traditional Name: [3-keto-1-(2,2,2-trichloroethoxycarbonylamino)butyl]phosphonic acid Formula: C7H11Cl3NO6P MolecularWeight: 342.498101

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(NC(=O)OCC(Cl)(Cl)Cl)P(=O)(O)O

Isomeric SMILES

CC(=O)CC(NC(=O)OCC(Cl)(Cl)Cl)P(=O)(O)O

InChI

InChI=1S/C7H11Cl3NO6P/c1-4(12)2-5(18(14,15)16)11-6(13)17-3-7(8,9)10/h5H,2-3H2,1H3,(H,11,13)(H2,14,15,16)