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

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-(oxolan-2-ylmethyl)imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-[1-(tetrahydrofuran-2-ylmethyl)imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-(2-oxolanylmethyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-(oxolan-2-ylmethyl)imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-[1-(tetrahydrofurfuryl)imidazol-4-yl]propionic acid Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)O

Isomeric SMILES

C1CC(OC1)CN2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)O

InChI

InChI=1S/C16H20N4O3/c17-15-4-3-11(7-18-15)6-13(16(21)22)14-9-20(10-19-14)8-12-2-1-5-23-12/h3-4,7,9-10,12-13H,1-2,5-6,8H2,(H2,17,18)(H,21,22)