2-[3-fluoranyl-4-(2-methylpropyl)phenyl]propanoic acid

Systemtic Name: 2-[3-fluoranyl-4-(2-methylpropyl)phenyl]propanoic acid Openeye Name: 2-(3-fluoro-4-isobutyl-phenyl)propanoic acid CAS Name: 2-[3-fluoro-4-(2-methylpropyl)phenyl]propanoic acid IUPAC Name: 2-[3-fluoro-4-(2-methylpropyl)phenyl]propanoic acid Traditional Name: 2-(3-fluoro-4-isobutyl-phenyl)propionic acid Formula: C13H17FO2 MolecularWeight: 224.271283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C(C=C1)C(C)C(=O)O)F

Isomeric SMILES

CC(C)CC1=C(C=C(C=C1)C(C)C(=O)O)F

InChI

InChI=1S/C13H17FO2/c1-8(2)6-11-5-4-10(7-12(11)14)9(3)13(15)16/h4-5,7-9H,6H2,1-3H3,(H,15,16)