3-[2-(6-chloranylpyridin-3-yl)-4-(4-methylphenyl)imidazol-1-yl]propanoic acid

Systemtic Name: 3-[2-(6-chloranylpyridin-3-yl)-4-(4-methylphenyl)imidazol-1-yl]propanoic acid Openeye Name: 3-[2-(6-chloro-3-pyridyl)-4-(p-tolyl)imidazol-1-yl]propanoic acid CAS Name: 3-[2-(6-chloro-3-pyridinyl)-4-(4-methylphenyl)-1-imidazolyl]propanoic acid IUPAC Name: 3-[2-(6-chloropyridin-3-yl)-4-(4-methylphenyl)imidazol-1-yl]propanoic acid Traditional Name: 3-[2-(6-chloro-3-pyridyl)-4-(p-tolyl)imidazol-1-yl]propionic acid Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN(C(=N2)C3=CN=C(C=C3)Cl)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN(C(=N2)C3=CN=C(C=C3)Cl)CCC(=O)O

InChI

InChI=1S/C18H16ClN3O2/c1-12-2-4-13(5-3-12)15-11-22(9-8-17(23)24)18(21-15)14-6-7-16(19)20-10-14/h2-7,10-11H,8-9H2,1H3,(H,23,24)