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

Systemtic Name: (2S)-3-phenyl-2-[2-(tetradecanoylamino)ethanoylamino]propanoic acid Openeye Name: (2S)-3-phenyl-2-[[2-(tetradecanoylamino)acetyl]amino]propanoic acid CAS Name: (2S)-2-[[1-oxo-2-(1-oxotetradecylamino)ethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-3-phenyl-2-[[2-(tetradecanoylamino)acetyl]amino]propanoic acid Traditional Name: (2S)-3-phenyl-2-[[2-(tetradecanoylamino)acetyl]amino]propionic acid Formula: C25H40N2O4 MolecularWeight: 432.5961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H40N2O4/c1-2-3-4-5-6-7-8-9-10-11-15-18-23(28)26-20-24(29)27-22(25(30)31)19-21-16-13-12-14-17-21/h12-14,16-17,22H,2-11,15,18-20H2,1H3,(H,26,28)(H,27,29)(H,30,31)/t22-/m0/s1