4-fluoranyl-3-(2-methylpentylamino)benzoic acid

Systemtic Name: 4-fluoranyl-3-(2-methylpentylamino)benzoic acid Openeye Name: 4-fluoro-3-(2-methylpentylamino)benzoic acid CAS Name: 4-fluoro-3-(2-methylpentylamino)benzoic acid IUPAC Name: 4-fluoro-3-(2-methylpentylamino)benzoic acid Traditional Name: 4-fluoro-3-(2-methylpentylamino)benzoic acid Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CNC1=C(C=CC(=C1)C(=O)O)F

Isomeric SMILES

CCCC(C)CNC1=C(C=CC(=C1)C(=O)O)F

InChI

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