(2S)-3-(1H-imidazol-5-yl)-2-(2-phenylethanoylamino)propanoic acid

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-(2-phenylethanoylamino)propanoic acid Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-phenylacetyl)amino]propanoic acid CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[(1-oxo-2-phenylethyl)amino]propanoic acid IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-phenylacetyl)amino]propanoic acid Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-phenylacetyl)amino]propionic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C14H15N3O3/c18-13(6-10-4-2-1-3-5-10)17-12(14(19)20)7-11-8-15-9-16-11/h1-5,8-9,12H,6-7H2,(H,15,16)(H,17,18)(H,19,20)/t12-/m0/s1