[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate

Systemtic Name: [(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate Openeye Name: [(1S)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoic acid [(1S)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate Traditional Name: 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoic acid [(1S)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C24H31N3O6S MolecularWeight: 489.58444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)NCCO)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)NCCO)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C24H31N3O6S/c1-26(2)34(31,32)19-11-12-21(25-13-16-28)20(17-19)24(30)33-22(18-9-5-3-6-10-18)23(29)27-14-7-4-8-15-27/h3,5-6,9-12,17,22,25,28H,4,7-8,13-16H2,1-2H3/t22-/m0/s1