ethyl (2R,3S)-2-(dodecanoylamino)-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: ethyl (2R,3S)-2-(dodecanoylamino)-3-oxidanyl-3-phenyl-propanoate Openeye Name: ethyl (2R,3S)-2-(dodecanoylamino)-3-hydroxy-3-phenyl-propanoate CAS Name: (2R,3S)-3-hydroxy-2-(1-oxododecylamino)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-(dodecanoylamino)-3-hydroxy-3-phenylpropanoate Traditional Name: (2R,3S)-3-hydroxy-2-(lauroylamino)-3-phenyl-propionic acid ethyl ester Formula: C23H37NO4 MolecularWeight: 391.54418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(C(C1=CC=CC=C1)O)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCC(=O)N[C@H]([C@H](C1=CC=CC=C1)O)C(=O)OCC

InChI

InChI=1S/C23H37NO4/c1-3-5-6-7-8-9-10-11-15-18-20(25)24-21(23(27)28-4-2)22(26)19-16-13-12-14-17-19/h12-14,16-17,21-22,26H,3-11,15,18H2,1-2H3,(H,24,25)/t21-,22+/m1/s1