ethyl (2S)-2-cyano-3-[(1S,2R)-1-morpholin-4-yl-1-phenyl-propan-2-yl]imino-propanoate

Systemtic Name: ethyl (2S)-2-cyano-3-[(1S,2R)-1-morpholin-4-yl-1-phenyl-propan-2-yl]imino-propanoate Openeye Name: ethyl (2S)-2-cyano-3-[(1R,2S)-1-methyl-2-morpholino-2-phenyl-ethyl]imino-propanoate CAS Name: (2S)-2-cyano-3-[(1S,2R)-1-(4-morpholinyl)-1-phenylpropan-2-yl]iminopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-3-[(1S,2R)-1-morpholin-4-yl-1-phenylpropan-2-yl]iminopropanoate Traditional Name: (2S)-2-cyano-3-[(1R,2S)-1-methyl-2-morpholino-2-phenyl-ethyl]imino-propionic acid ethyl ester Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NC(C)C(C1=CC=CC=C1)N2CCOCC2)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=N[C@H](C)[C@H](C1=CC=CC=C1)N2CCOCC2)C#N

InChI

InChI=1S/C19H25N3O3/c1-3-25-19(23)17(13-20)14-21-15(2)18(16-7-5-4-6-8-16)22-9-11-24-12-10-22/h4-8,14-15,17-18H,3,9-12H2,1-2H3/t15-,17-,18-/m1/s1