(2-methoxy-5-methyl-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

InChI

InChI=1S/C19H20N2O5S/c1-14-4-9-18(25-2)16(12-14)13-26-19(22)15-5-7-17(8-6-15)27(23,24)21-11-3-10-20/h4-9,12,21H,3,11,13H2,1-2H3