3-fluoranyl-4-(2-propan-2-ylimidazol-1-yl)benzoic acid

Systemtic Name: 3-fluoranyl-4-(2-propan-2-ylimidazol-1-yl)benzoic acid Openeye Name: 3-fluoro-4-(2-isopropylimidazol-1-yl)benzoic acid CAS Name: 3-fluoro-4-(2-propan-2-yl-1-imidazolyl)benzoic acid IUPAC Name: 3-fluoro-4-(2-propan-2-ylimidazol-1-yl)benzoic acid Traditional Name: 3-fluoro-4-(2-isopropylimidazol-1-yl)benzoic acid Formula: C13H13FN2O2 MolecularWeight: 248.252923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=CN1C2=C(C=C(C=C2)C(=O)O)F

Isomeric SMILES

CC(C)C1=NC=CN1C2=C(C=C(C=C2)C(=O)O)F

InChI

InChI=1S/C13H13FN2O2/c1-8(2)12-15-5-6-16(12)11-4-3-9(13(17)18)7-10(11)14/h3-8H,1-2H3,(H,17,18)