[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] (2S)-2-(4-phenoxyphenyl)propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] (2S)-2-(4-phenoxyphenyl)propanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl] (2S)-2-(4-phenoxyphenyl)propanoate CAS Name: (2S)-2-(4-phenoxyphenyl)propanoic acid [(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl] (2S)-2-(4-phenoxyphenyl)propanoate Traditional Name: (2S)-2-(4-phenoxyphenyl)propionic acid [(1S)-2-keto-1-methyl-2-piperidino-ethyl] ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)OC(C)C(=O)N3CCCCC3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)O[C@@H](C)C(=O)N3CCCCC3

InChI

InChI=1S/C23H27NO4/c1-17(23(26)27-18(2)22(25)24-15-7-4-8-16-24)19-11-13-21(14-12-19)28-20-9-5-3-6-10-20/h3,5-6,9-14,17-18H,4,7-8,15-16H2,1-2H3/t17-,18-/m0/s1