3-(4-fluoranylimidazol-4-yl)-2-(propanoylamino)propanoic acid

Systemtic Name: 3-(4-fluoranylimidazol-4-yl)-2-(propanoylamino)propanoic acid Openeye Name: 3-(4-fluoroimidazol-4-yl)-2-(propanoylamino)propanoic acid CAS Name: 3-(4-fluoro-4-imidazolyl)-2-(1-oxopropylamino)propanoic acid IUPAC Name: 3-(4-fluoroimidazol-4-yl)-2-(propanoylamino)propanoic acid Traditional Name: 3-(4-fluoroimidazol-4-yl)-2-propionamido-propionic acid Formula: C9H12FN3O3 MolecularWeight: 229.208283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC1(C=NC=N1)F)C(=O)O

Isomeric SMILES

CCC(=O)NC(CC1(C=NC=N1)F)C(=O)O

InChI

InChI=1S/C9H12FN3O3/c1-2-7(14)13-6(8(15)16)3-9(10)4-11-5-12-9/h4-6H,2-3H2,1H3,(H,13,14)(H,15,16)