2-fluoranyl-5-(3-methylpentan-2-ylamino)benzoic acid

Systemtic Name: 2-fluoranyl-5-(3-methylpentan-2-ylamino)benzoic acid Openeye Name: 5-(1,2-dimethylbutylamino)-2-fluoro-benzoic acid CAS Name: 2-fluoro-5-(3-methylpentan-2-ylamino)benzoic acid IUPAC Name: 2-fluoro-5-(3-methylpentan-2-ylamino)benzoic acid Traditional Name: 5-(1,2-dimethylbutylamino)-2-fluoro-benzoic acid Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)NC1=CC(=C(C=C1)F)C(=O)O

Isomeric SMILES

CCC(C)C(C)NC1=CC(=C(C=C1)F)C(=O)O

InChI

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