4-oxidanylidene-3-[2-[2-(3-phenylpropanoylamino)ethanoylamino]propanoylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[2-[2-(3-phenylpropanoylamino)ethanoylamino]propanoylamino]butanoic acid Openeye Name: 4-oxo-3-[2-[[2-(3-phenylpropanoylamino)acetyl]amino]propanoylamino]butanoic acid CAS Name: 4-oxo-3-[[1-oxo-2-[[1-oxo-2-[(1-oxo-3-phenylpropyl)amino]ethyl]amino]propyl]amino]butanoic acid IUPAC Name: 4-oxo-3-[2-[[2-(3-phenylpropanoylamino)acetyl]amino]propanoylamino]butanoic acid Traditional Name: 3-[2-[[2-(hydrocinnamoylamino)acetyl]amino]propanoylamino]-4-keto-butyric acid Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C=O)NC(=O)CNC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C=O)NC(=O)CNC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C18H23N3O6/c1-12(18(27)21-14(11-22)9-17(25)26)20-16(24)10-19-15(23)8-7-13-5-3-2-4-6-13/h2-6,11-12,14H,7-10H2,1H3,(H,19,23)(H,20,24)(H,21,27)(H,25,26)