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

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(diethylsulfamoyl)phenyl]propanoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 3-[4-(diethylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(diethylsulfamoyl)phenyl]propionic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C20H32N2O5S MolecularWeight: 412.54348

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)NCCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H32N2O5S/c1-5-22(6-2)28(25,26)18-10-7-17(8-11-18)9-12-20(24)27-15-19(23)21-14-13-16(3)4/h7-8,10-11,16H,5-6,9,12-15H2,1-4H3,(H,21,23)