[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: [(1S)-2-morpholino-2-oxo-1-phenyl-ethyl] 1-(4-chlorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxylic acid [(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 1-(4-chlorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-chlorobenzoyl)isonipecotic acid [(1S)-2-keto-2-morpholino-1-phenyl-ethyl] ester Formula: C25H27ClN2O5 MolecularWeight: 470.94528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H27ClN2O5/c26-21-8-6-19(7-9-21)23(29)27-12-10-20(11-13-27)25(31)33-22(18-4-2-1-3-5-18)24(30)28-14-16-32-17-15-28/h1-9,20,22H,10-17H2/t22-/m0/s1