methyl 4-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]prop-2-enoyl]amino]benzoate Openeye Name: methyl 4-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxyphenyl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]acryloyl]amino]benzoic acid methyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C=CC(=O)NC2=CC=C(C=C2)C(=O)OC)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)OC)OC

InChI

InChI=1S/C20H22N2O6S/c1-22(2)29(25,26)18-13-14(5-11-17(18)27-3)6-12-19(23)21-16-9-7-15(8-10-16)20(24)28-4/h5-13H,1-4H3,(H,21,23)/b12-6+