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

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-(3-phenylpropyl)imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-[1-(3-phenylpropyl)imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-(3-phenylpropyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-(3-phenylpropyl)imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-[1-(3-phenylpropyl)imidazol-4-yl]propionic acid Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)O

InChI

InChI=1S/C20H22N4O2/c21-19-9-8-16(12-22-19)11-17(20(25)26)18-13-24(14-23-18)10-4-7-15-5-2-1-3-6-15/h1-3,5-6,8-9,12-14,17H,4,7,10-11H2,(H2,21,22)(H,25,26)