[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] (2R)-2-(4-chloranylphenoxy)butanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] (2R)-2-(4-chloranylphenoxy)butanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl] (2R)-2-(4-chlorophenoxy)butanoate CAS Name: (2R)-2-(4-chlorophenoxy)butanoic acid [(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl] (2R)-2-(4-chlorophenoxy)butanoate Traditional Name: (2R)-2-(4-chlorophenoxy)butyric acid [(1S)-2-keto-1-methyl-2-piperidino-ethyl] ester Formula: C18H24ClNO4 MolecularWeight: 353.84046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C)C(=O)N1CCCCC1)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[C@H](C(=O)O[C@@H](C)C(=O)N1CCCCC1)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H24ClNO4/c1-3-16(24-15-9-7-14(19)8-10-15)18(22)23-13(2)17(21)20-11-5-4-6-12-20/h7-10,13,16H,3-6,11-12H2,1-2H3/t13-,16+/m0/s1