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

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-[1-[2-oxo-2-(4-phenylphenyl)ethyl]imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-[2-oxo-2-(4-phenylphenyl)ethyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-[2-oxo-2-(4-phenylphenyl)ethyl]imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-[1-[2-keto-2-(4-phenylphenyl)ethyl]imidazol-4-yl]propionic acid Formula: C25H22N4O3 MolecularWeight: 426.46718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CN3C=C(N=C3)C(CC4=CN=C(C=C4)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CN3C=C(N=C3)C(CC4=CN=C(C=C4)N)C(=O)O

InChI

InChI=1S/C25H22N4O3/c26-24-11-6-17(13-27-24)12-21(25(31)32)22-14-29(16-28-22)15-23(30)20-9-7-19(8-10-20)18-4-2-1-3-5-18/h1-11,13-14,16,21H,12,15H2,(H2,26,27)(H,31,32)