[4-(cyanomethyl)phenyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: [4-(cyanomethyl)phenyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: [4-(cyanomethyl)phenyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(diethylsulfamoyl)phenyl]-2-propenoic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(diethylsulfamoyl)phenyl]acrylic acid [4-(cyanomethyl)phenyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)CC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)OC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C21H22N2O4S/c1-3-23(4-2)28(25,26)20-12-7-17(8-13-20)9-14-21(24)27-19-10-5-18(6-11-19)15-16-22/h5-14H,3-4,15H2,1-2H3/b14-9+