3-fluoranyl-4-[methyl(pentan-3-yl)amino]benzoic acid

Systemtic Name: 3-fluoranyl-4-[methyl(pentan-3-yl)amino]benzoic acid Openeye Name: 4-[1-ethylpropyl(methyl)amino]-3-fluoro-benzoic acid CAS Name: 3-fluoro-4-[methyl(pentan-3-yl)amino]benzoic acid IUPAC Name: 3-fluoro-4-[methyl(pentan-3-yl)amino]benzoic acid Traditional Name: 4-[1-ethylpropyl(methyl)amino]-3-fluoro-benzoic acid Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N(C)C1=C(C=C(C=C1)C(=O)O)F

Isomeric SMILES

CCC(CC)N(C)C1=C(C=C(C=C1)C(=O)O)F

InChI

InChI=1S/C13H18FNO2/c1-4-10(5-2)15(3)12-7-6-9(13(16)17)8-11(12)14/h6-8,10H,4-5H2,1-3H3,(H,16,17)