[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-[4-(methylsulfamoyl)phenyl]propanoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-[4-(methylsulfamoyl)phenyl]propanoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 3-[4-(methylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(methylsulfamoyl)phenyl]propanoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 3-[4-(methylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(methylsulfamoyl)phenyl]propionic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)NC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)NC

InChI

InChI=1S/C21H25NO5S/c1-4-16-5-10-18(11-6-16)21(24)15(2)27-20(23)14-9-17-7-12-19(13-8-17)28(25,26)22-3/h5-8,10-13,15,22H,4,9,14H2,1-3H3