1-[(2S)-2-[(1S)-1-chloranyl-2-(4-phenylmethoxyphenoxy)ethyl]piperidin-1-yl]ethanone

Systemtic Name: 1-[(2S)-2-[(1S)-1-chloranyl-2-(4-phenylmethoxyphenoxy)ethyl]piperidin-1-yl]ethanone Openeye Name: 1-[(2S)-2-[(1S)-2-(4-benzyloxyphenoxy)-1-chloro-ethyl]-1-piperidyl]ethanone CAS Name: 1-[(2S)-2-[(1S)-1-chloro-2-(4-phenylmethoxyphenoxy)ethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[(2S)-2-[(1S)-1-chloro-2-(4-phenylmethoxyphenoxy)ethyl]piperidin-1-yl]ethanone Traditional Name: 1-[(2S)-2-[(1S)-2-(4-benzoxyphenoxy)-1-chloro-ethyl]piperidino]ethanone Formula: C22H26ClNO3 MolecularWeight: 387.89974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCCC1C(COC2=CC=C(C=C2)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)N1CCCC[C@H]1[C@@H](COC2=CC=C(C=C2)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H26ClNO3/c1-17(25)24-14-6-5-9-22(24)21(23)16-27-20-12-10-19(11-13-20)26-15-18-7-3-2-4-8-18/h2-4,7-8,10-13,21-22H,5-6,9,14-16H2,1H3/t21-,22+/m1/s1