2-[3-[(4-butoxy-3-fluoranyl-phenyl)methyl]-2-butyl-5-chloranyl-imidazol-4-yl]ethanoic acid

Systemtic Name: 2-[3-[(4-butoxy-3-fluoranyl-phenyl)methyl]-2-butyl-5-chloranyl-imidazol-4-yl]ethanoic acid Openeye Name: 2-[3-[(4-butoxy-3-fluoranyl-phenyl)methyl]-2-butyl-5-chloro-imidazol-4-yl]acetic acid CAS Name: 2-[3-[(4-butoxy-3-fluoranylphenyl)methyl]-2-butyl-5-chloro-4-imidazolyl]acetic acid IUPAC Name: 2-[3-[(4-butoxy-3-fluoranylphenyl)methyl]-2-butyl-5-chloroimidazol-4-yl]acetic acid Traditional Name: 2-[3-(4-butoxy-3-fluoranyl-benzyl)-2-butyl-5-chloro-imidazol-4-yl]acetic acid Formula: C20H26ClFN2O3 MolecularWeight: 395.885978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)OCCCC)F)CC(=O)O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)OCCCC)[18F])CC(=O)O)Cl

InChI

InChI=1S/C20H26ClFN2O3/c1-3-5-7-18-23-20(21)16(12-19(25)26)24(18)13-14-8-9-17(15(22)11-14)27-10-6-4-2/h8-9,11H,3-7,10,12-13H2,1-2H3,(H,25,26)/i22-1