(2S)-3-(4-hydroxyphenyl)-2-[2-(tetradecanoylamino)ethanoylamino]propanoic acid

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-[2-(tetradecanoylamino)ethanoylamino]propanoic acid Openeye Name: (2S)-3-(4-hydroxyphenyl)-2-[[2-(tetradecanoylamino)acetyl]amino]propanoic acid CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[1-oxo-2-(1-oxotetradecylamino)ethyl]amino]propanoic acid IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-[[2-(tetradecanoylamino)acetyl]amino]propanoic acid Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[[2-(tetradecanoylamino)acetyl]amino]propionic acid Formula: C25H40N2O5 MolecularWeight: 448.5955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C25H40N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-23(29)26-19-24(30)27-22(25(31)32)18-20-14-16-21(28)17-15-20/h14-17,22,28H,2-13,18-19H2,1H3,(H,26,29)(H,27,30)(H,31,32)/t22-/m0/s1