[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(diethylsulfamoyl)phenyl]propanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(diethylsulfamoyl)phenyl]propionic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C23H29NO5S MolecularWeight: 431.54506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)OCC(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)OCC(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C23H29NO5S/c1-5-24(6-2)30(27,28)21-12-8-19(9-13-21)10-14-23(26)29-16-22(25)20-11-7-17(3)18(4)15-20/h7-9,11-13,15H,5-6,10,14,16H2,1-4H3