3-[3-[[(3-azanylpyridin-4-yl)amino]methyl]furan-2-yl]propanoic acid

Systemtic Name: 3-[3-[[(3-azanylpyridin-4-yl)amino]methyl]furan-2-yl]propanoic acid Openeye Name: 3-[3-[[(3-amino-4-pyridyl)amino]methyl]-2-furyl]propanoic acid CAS Name: 3-[3-[[(3-amino-4-pyridinyl)amino]methyl]-2-furanyl]propanoic acid IUPAC Name: 3-[3-[[(3-aminopyridin-4-yl)amino]methyl]furan-2-yl]propanoic acid Traditional Name: 3-[3-[[(3-amino-4-pyridyl)amino]methyl]-2-furyl]propionic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC(=C1NCC2=C(OC=C2)CCC(=O)O)N

Isomeric SMILES

C1=CN=CC(=C1NCC2=C(OC=C2)CCC(=O)O)N

InChI

InChI=1S/C13H15N3O3/c14-10-8-15-5-3-11(10)16-7-9-4-6-19-12(9)1-2-13(17)18/h3-6,8H,1-2,7,14H2,(H,15,16)(H,17,18)