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

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-(2-phenylethanoylamino)propanoate Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-phenylacetyl)amino]propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[(1-oxo-2-phenylethyl)amino]propanoate IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-phenylacetyl)amino]propanoate Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-phenylacetyl)amino]propionate Formula: C14H14N3O3- MolecularWeight: 272.27926

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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)/p-1/t12-/m0/s1