(3-fluoranyl-4-methoxy-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C18H17FN2O5S MolecularWeight: 392.401383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)F

InChI

InChI=1S/C18H17FN2O5S/c1-25-17-8-3-13(11-16(17)19)12-26-18(22)14-4-6-15(7-5-14)27(23,24)21-10-2-9-20/h3-8,11,21H,2,10,12H2,1H3