3-(6-azanylpyridin-3-yl)-2-[1-(2-oxidanylidenepropyl)imidazol-4-yl]propanoic acid

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-(2-oxidanylidenepropyl)imidazol-4-yl]propanoic acid Openeye Name: 2-(1-acetonylimidazol-4-yl)-3-(6-amino-3-pyridyl)propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-(2-oxopropyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-(2-oxopropyl)imidazol-4-yl]propanoic acid Traditional Name: 2-(1-acetonylimidazol-4-yl)-3-(6-amino-3-pyridyl)propionic acid Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C=C(N=C1)C(CC2=CN=C(C=C2)N)C(=O)O

Isomeric SMILES

CC(=O)CN1C=C(N=C1)C(CC2=CN=C(C=C2)N)C(=O)O

InChI

InChI=1S/C14H16N4O3/c1-9(19)6-18-7-12(17-8-18)11(14(20)21)4-10-2-3-13(15)16-5-10/h2-3,5,7-8,11H,4,6H2,1H3,(H2,15,16)(H,20,21)