[(2S)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] (2S)-2-phenoxypropanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] (2S)-2-phenoxypropanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] (2S)-2-phenoxypropanoate CAS Name: (2S)-2-phenoxypropanoic acid [(2S)-1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl] (2S)-2-phenoxypropanoate Traditional Name: (2S)-2-phenoxypropionic acid [(1S)-2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C23H28N2O6S MolecularWeight: 460.54322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)OC(=O)C(C)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)OC(=O)[C@H](C)OC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O6S/c1-17(31-23(27)18(2)30-20-9-5-3-6-10-20)22(26)24-19-11-13-21(14-12-19)32(28,29)25-15-7-4-8-16-25/h3,5-6,9-14,17-18H,4,7-8,15-16H2,1-2H3,(H,24,26)/t17-,18-/m0/s1