2,2-dimethylpropanoyloxymethoxy-[4-ethyl-2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-oxidanylidene-phosphanium

Systemtic Name: 2,2-dimethylpropanoyloxymethoxy-[4-ethyl-2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-oxidanylidene-phosphanium Openeye Name: 2,2-dimethylpropanoyloxymethoxy-[4-ethyl-2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-oxo-phosphonium CAS Name: (2,2-dimethyl-1-oxopropoxy)methoxy-[4-ethyl-2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-oxophosphonium IUPAC Name: 2,2-dimethylpropanoyloxymethoxy-[4-ethyl-2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-oxophosphanium Traditional Name: [4-ethyl-2-nitro-5-[4-(trifluoromethyl)phenoxy]phenyl]-keto-(pivaloyloxymethoxy)phosphonium Formula: C21H22F3NO7P+ MolecularWeight: 488.370851

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OC2=CC=C(C=C2)C(F)(F)F)[P+](=O)OCOC(=O)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C=C1OC2=CC=C(C=C2)C(F)(F)F)[P+](=O)OCOC(=O)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H22F3NO7P/c1-5-13-10-16(25(27)28)18(33(29)31-12-30-19(26)20(2,3)4)11-17(13)32-15-8-6-14(7-9-15)21(22,23)24/h6-11H,5,12H2,1-4H3/q+1