3-[[(2S)-3-phenyl-2-(undec-10-enoylamino)propanoyl]amino]propanoic acid

Systemtic Name: 3-[[(2S)-3-phenyl-2-(undec-10-enoylamino)propanoyl]amino]propanoic acid Openeye Name: 3-[[(2S)-3-phenyl-2-(undec-10-enoylamino)propanoyl]amino]propanoic acid CAS Name: 3-[[(2S)-1-oxo-2-(1-oxoundec-10-enylamino)-3-phenylpropyl]amino]propanoic acid IUPAC Name: 3-[[(2S)-3-phenyl-2-(undec-10-enoylamino)propanoyl]amino]propanoic acid Traditional Name: 3-[[(2S)-3-phenyl-2-(undec-10-enoylamino)propanoyl]amino]propionic acid Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)NCCC(=O)O

Isomeric SMILES

C=CCCCCCCCCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCC(=O)O

InChI

InChI=1S/C23H34N2O4/c1-2-3-4-5-6-7-8-12-15-21(26)25-20(18-19-13-10-9-11-14-19)23(29)24-17-16-22(27)28/h2,9-11,13-14,20H,1,3-8,12,15-18H2,(H,24,29)(H,25,26)(H,27,28)/t20-/m0/s1