3-(6-azanylpyridin-3-yl)-2-[1-[2-(methylamino)-2-oxidanylidene-ethyl]imidazol-4-yl]propanoic acid

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-[2-(methylamino)-2-oxidanylidene-ethyl]imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-[1-[2-(methylamino)-2-oxo-ethyl]imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-[2-(methylamino)-2-oxoethyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-[2-(methylamino)-2-oxoethyl]imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-[1-[2-keto-2-(methylamino)ethyl]imidazol-4-yl]propionic acid Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O3/c1-16-13(20)7-19-6-11(18-8-19)10(14(21)22)4-9-2-3-12(15)17-5-9/h2-3,5-6,8,10H,4,7H2,1H3,(H2,15,17)(H,16,20)(H,21,22)