(4-cyanophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (4-cyanophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (4-cyanophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (4-cyanobenzyl) ester Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)C#N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)C#N

InChI

InChI=1S/C18H15N3O4S/c19-10-1-11-21-26(23,24)17-8-6-16(7-9-17)18(22)25-13-15-4-2-14(12-20)3-5-15/h2-9,21H,1,11,13H2