4-(2-chloroethylsulfamoyloxy)but-3-yn-2-yl-[3-(trifluoromethyl)phenyl]carbamic acid

Systemtic Name: 4-(2-chloroethylsulfamoyloxy)but-3-yn-2-yl-[3-(trifluoromethyl)phenyl]carbamic acid Openeye Name: [3-(2-chloroethylsulfamoyloxy)-1-methyl-prop-2-ynyl]-[3-(trifluoromethyl)phenyl]carbamic acid CAS Name: 4-(2-chloroethylsulfamoyloxy)but-3-yn-2-yl-[3-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: 4-(2-chloroethylsulfamoyloxy)but-3-yn-2-yl-[3-(trifluoromethyl)phenyl]carbamic acid Traditional Name: [3-(2-chloroethylsulfamoyloxy)-1-methyl-prop-2-ynyl]-[3-(trifluoromethyl)phenyl]carbamic acid Formula: C14H14ClF3N2O5S MolecularWeight: 414.78457

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#COS(=O)(=O)NCCCl)N(C1=CC=CC(=C1)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C#COS(=O)(=O)NCCCl)N(C1=CC=CC(=C1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H14ClF3N2O5S/c1-10(5-8-25-26(23,24)19-7-6-15)20(13(21)22)12-4-2-3-11(9-12)14(16,17)18/h2-4,9-10,19H,6-7H2,1H3,(H,21,22)