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

Systemtic Name: (2-nitrophenyl)methyl (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (2-nitrophenyl)methyl (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(diethylsulfamoyl)phenyl]-2-propenoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(diethylsulfamoyl)phenyl]acrylic acid (2-nitrobenzyl) ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)OCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6S/c1-3-21(4-2)29(26,27)18-12-9-16(10-13-18)11-14-20(23)28-15-17-7-5-6-8-19(17)22(24)25/h5-14H,3-4,15H2,1-2H3/b14-11+