(2-chloranyl-4-fluoranyl-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-chloro-4-fluoro-benzyl) ester Formula: C17H14ClFN2O4S MolecularWeight: 396.820463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=C(C=C(C=C2)F)Cl)S(=O)(=O)NCCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=C(C=C(C=C2)F)Cl)S(=O)(=O)NCCC#N

InChI

InChI=1S/C17H14ClFN2O4S/c18-16-10-14(19)5-2-13(16)11-25-17(22)12-3-6-15(7-4-12)26(23,24)21-9-1-8-20/h2-7,10,21H,1,9,11H2