[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-[4-(diethylsulfamoyl)phenyl]propanoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(diethylsulfamoyl)phenyl]propanoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(diethylsulfamoyl)phenyl]propionic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)OC(C)C(=O)NCC=C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)OC(C)C(=O)NCC=C

InChI

InChI=1S/C19H28N2O5S/c1-5-14-20-19(23)15(4)26-18(22)13-10-16-8-11-17(12-9-16)27(24,25)21(6-2)7-3/h5,8-9,11-12,15H,1,6-7,10,13-14H2,2-4H3,(H,20,23)