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

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-[2-(ethylamino)-2-oxidanylidene-ethyl]imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-[1-[2-(ethylamino)-2-oxo-ethyl]imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-[2-(ethylamino)-2-oxoethyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-[2-(ethylamino)-2-oxoethyl]imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-[1-[2-(ethylamino)-2-keto-ethyl]imidazol-4-yl]propionic acid Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O3/c1-2-17-14(21)8-20-7-12(19-9-20)11(15(22)23)5-10-3-4-13(16)18-6-10/h3-4,6-7,9,11H,2,5,8H2,1H3,(H2,16,18)(H,17,21)(H,22,23)