3-fluoranyl-4-[methyl(2-methylbutyl)amino]benzoic acid

Systemtic Name: 3-fluoranyl-4-[methyl(2-methylbutyl)amino]benzoic acid Openeye Name: 3-fluoro-4-[methyl(2-methylbutyl)amino]benzoic acid CAS Name: 3-fluoro-4-[methyl(2-methylbutyl)amino]benzoic acid IUPAC Name: 3-fluoro-4-[methyl(2-methylbutyl)amino]benzoic acid Traditional Name: 3-fluoro-4-[methyl(2-methylbutyl)amino]benzoic acid Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(C)C1=C(C=C(C=C1)C(=O)O)F

Isomeric SMILES

CCC(C)CN(C)C1=C(C=C(C=C1)C(=O)O)F

InChI

InChI=1S/C13H18FNO2/c1-4-9(2)8-15(3)12-6-5-10(13(16)17)7-11(12)14/h5-7,9H,4,8H2,1-3H3,(H,16,17)