ethyl (2S)-2-ethoxy-3-[4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]propanoate

Systemtic Name: ethyl (2S)-2-ethoxy-3-[4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]propanoate Openeye Name: ethyl (2S)-2-ethoxy-3-[4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]propanoate CAS Name: (2S)-2-ethoxy-3-[4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-ethoxy-3-[4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]propanoate Traditional Name: (2S)-2-ethoxy-3-[4-[2-keto-2-(phenethylamino)ethoxy]phenyl]propionic acid ethyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCC(=O)NCCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCO[C@@H](CC1=CC=C(C=C1)OCC(=O)NCCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C23H29NO5/c1-3-27-21(23(26)28-4-2)16-19-10-12-20(13-11-19)29-17-22(25)24-15-14-18-8-6-5-7-9-18/h5-13,21H,3-4,14-17H2,1-2H3,(H,24,25)/t21-/m0/s1