3-(6-azanylpyridin-3-yl)-2-(1-pentylimidazol-4-yl)propanoic acid

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-(1-pentylimidazol-4-yl)propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-(1-pentylimidazol-4-yl)propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-(1-pentyl-4-imidazolyl)propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-(1-pentylimidazol-4-yl)propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-(1-amylimidazol-4-yl)propionic acid Formula: C16H22N4O2 MolecularWeight: 302.37148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(N=C1)C(CC2=CN=C(C=C2)N)C(=O)O

Isomeric SMILES

CCCCCN1C=C(N=C1)C(CC2=CN=C(C=C2)N)C(=O)O

InChI

InChI=1S/C16H22N4O2/c1-2-3-4-7-20-10-14(19-11-20)13(16(21)22)8-12-5-6-15(17)18-9-12/h5-6,9-11,13H,2-4,7-8H2,1H3,(H2,17,18)(H,21,22)