[3-naphthalen-2-yl-3-oxidanylidene-1-[2,2,2-tris(chloranyl)ethoxycarbonylamino]propyl]phosphonic acid

Systemtic Name: [3-naphthalen-2-yl-3-oxidanylidene-1-[2,2,2-tris(chloranyl)ethoxycarbonylamino]propyl]phosphonic acid Openeye Name: [3-(2-naphthyl)-3-oxo-1-(2,2,2-trichloroethoxycarbonylamino)propyl]phosphonic acid CAS Name: [3-(2-naphthalenyl)-3-oxo-1-[[oxo(2,2,2-trichloroethoxy)methyl]amino]propyl]phosphonic acid IUPAC Name: [3-naphthalen-2-yl-3-oxo-1-(2,2,2-trichloroethoxycarbonylamino)propyl]phosphonic acid Traditional Name: [3-keto-3-(2-naphthyl)-1-(2,2,2-trichloroethoxycarbonylamino)propyl]phosphonic acid Formula: C16H15Cl3NO6P MolecularWeight: 454.626161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)CC(NC(=O)OCC(Cl)(Cl)Cl)P(=O)(O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)CC(NC(=O)OCC(Cl)(Cl)Cl)P(=O)(O)O

InChI

InChI=1S/C16H15Cl3NO6P/c17-16(18,19)9-26-15(22)20-14(27(23,24)25)8-13(21)12-6-5-10-3-1-2-4-11(10)7-12/h1-7,14H,8-9H2,(H,20,22)(H2,23,24,25)