methyl 4-phenyl-4-[2,2,2-tris(chloranyl)ethoxysulfonylamino]butanoate

Systemtic Name: methyl 4-phenyl-4-[2,2,2-tris(chloranyl)ethoxysulfonylamino]butanoate Openeye Name: methyl 4-phenyl-4-(2,2,2-trichloroethoxysulfonylamino)butanoate CAS Name: 4-phenyl-4-(2,2,2-trichloroethoxysulfonylamino)butanoic acid methyl ester IUPAC Name: methyl 4-phenyl-4-(2,2,2-trichloroethoxysulfonylamino)butanoate Traditional Name: 4-phenyl-4-(2,2,2-trichloroethoxysulfonylamino)butyric acid methyl ester Formula: C13H16Cl3NO5S MolecularWeight: 404.69384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C1=CC=CC=C1)NS(=O)(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

COC(=O)CCC(C1=CC=CC=C1)NS(=O)(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C13H16Cl3NO5S/c1-21-12(18)8-7-11(10-5-3-2-4-6-10)17-23(19,20)22-9-13(14,15)16/h2-6,11,17H,7-9H2,1H3