ethyl 2-[(2S,3S,4S)-2-cyano-4-ethyl-1-(phenylmethyl)azetidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[(2S,3S,4S)-2-cyano-4-ethyl-1-(phenylmethyl)azetidin-3-yl]ethanoate Openeye Name: ethyl 2-[(2S,3S,4S)-1-benzyl-2-cyano-4-ethyl-azetidin-3-yl]acetate CAS Name: 2-[(2S,3S,4S)-2-cyano-4-ethyl-1-(phenylmethyl)-3-azetidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S,3S,4S)-1-benzyl-2-cyano-4-ethylazetidin-3-yl]acetate Traditional Name: 2-[(2S,3S,4S)-1-benzyl-2-cyano-4-ethyl-azetidin-3-yl]acetic acid ethyl ester Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(N1CC2=CC=CC=C2)C#N)CC(=O)OCC

Isomeric SMILES

CC[C@H]1[C@@H]([C@H](N1CC2=CC=CC=C2)C#N)CC(=O)OCC

InChI

InChI=1S/C17H22N2O2/c1-3-15-14(10-17(20)21-4-2)16(11-18)19(15)12-13-8-6-5-7-9-13/h5-9,14-16H,3-4,10,12H2,1-2H3/t14-,15-,16+/m0/s1