ethyl (2S)-2-(dodecanoylamino)-3-(4-hydroxyphenyl)propanoate

Systemtic Name: ethyl (2S)-2-(dodecanoylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: ethyl (2S)-2-(dodecanoylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-(1-oxododecylamino)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(dodecanoylamino)-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-(lauroylamino)propionic acid ethyl ester Formula: C23H37NO4 MolecularWeight: 391.54418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)OCC

InChI

InChI=1S/C23H37NO4/c1-3-5-6-7-8-9-10-11-12-13-22(26)24-21(23(27)28-4-2)18-19-14-16-20(25)17-15-19/h14-17,21,25H,3-13,18H2,1-2H3,(H,24,26)/t21-/m0/s1