3-(6-azanylpyridin-3-yl)-3-[1-[(5-phenyl-1,2-oxazol-3-yl)methyl]imidazol-4-yl]propanoic acid

Systemtic Name: 3-(6-azanylpyridin-3-yl)-3-[1-[(5-phenyl-1,2-oxazol-3-yl)methyl]imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-3-[1-[(5-phenylisoxazol-3-yl)methyl]imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-3-[1-[(5-phenyl-3-isoxazolyl)methyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-3-[1-[(5-phenyl-1,2-oxazol-3-yl)methyl]imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-3-[1-[(5-phenylisoxazol-3-yl)methyl]imidazol-4-yl]propionic acid Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CN3C=C(N=C3)C(CC(=O)O)C4=CN=C(C=C4)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CN3C=C(N=C3)C(CC(=O)O)C4=CN=C(C=C4)N

InChI

InChI=1S/C21H19N5O3/c22-20-7-6-15(10-23-20)17(9-21(27)28)18-12-26(13-24-18)11-16-8-19(29-25-16)14-4-2-1-3-5-14/h1-8,10,12-13,17H,9,11H2,(H2,22,23)(H,27,28)