ethyl 2-[phenyl(trifluoromethylsulfonyl)amino]ethanoate; iodanylpalladium(1+); (1R,2R)-N1,N1,N2,N2-tetramethylcyclohexane-1,2-diamine

Systemtic Name: ethyl 2-[phenyl(trifluoromethylsulfonyl)amino]ethanoate; iodanylpalladium(1+); (1R,2R)-N1,N1,N2,N2-tetramethylcyclohexane-1,2-diamine Openeye Name: ethyl 2-[N-(trifluoromethylsulfonyl)anilino]acetate; iodopalladium(1+); (1R,2R)-N1,N1,N2,N2-tetramethylcyclohexane-1,2-diamine CAS Name: iodopalladium(1+); (1R,2R)-N1,N1,N2,N2-tetramethylcyclohexane-1,2-diamine; 2-[N-(trifluoromethylsulfonyl)anilino]acetic acid ethyl ester IUPAC Name: ethyl 2-[N-(trifluoromethylsulfonyl)anilino]acetate; iodopalladium(1+); (1R,2R)-1-N,1-N,2-N,2-N-tetramethylcyclohexane-1,2-diamine Traditional Name: [(1R,2R)-2-(dimethylamino)cyclohexyl]-dimethyl-amine; iodopalladium(1+); 2-(N-triflylanilino)acetic acid ethyl ester Formula: C21H33F3IN3O4PdS MolecularWeight: 713.8891

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=C[C-]=CC=C1)S(=O)(=O)C(F)(F)F.CN(C)C1CCCCC1N(C)C.[Pd+]I

Isomeric SMILES

CCOC(=O)CN(C1=C[C-]=CC=C1)S(=O)(=O)C(F)(F)F.CN(C)[C@@H]1CCCC[C@H]1N(C)C.[Pd+]I

InChI

InChI=1S/C11H11F3NO4S.C10H22N2.HI.Pd/c1-2-19-10(16)8-15(9-6-4-3-5-7-9)20(17,18)11(12,13)14;1-11(2)9-7-5-6-8-10(9)12(3)4;;/h3-4,6-7H,2,8H2,1H3;9-10H,5-8H2,1-4H3;1H;/q-1;;;+2/p-1/t;9-,10-;;/m.1../s1