3-(butan-2-ylamino)-4-fluoranyl-benzoic acid

Systemtic Name: 3-(butan-2-ylamino)-4-fluoranyl-benzoic acid Openeye Name: 4-fluoro-3-(sec-butylamino)benzoic acid CAS Name: 3-(butan-2-ylamino)-4-fluorobenzoic acid IUPAC Name: 3-(butan-2-ylamino)-4-fluorobenzoic acid Traditional Name: 4-fluoro-3-(sec-butylamino)benzoic acid Formula: C11H14FNO2 MolecularWeight: 211.232763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14FNO2/c1-3-7(2)13-10-6-8(11(14)15)4-5-9(10)12/h4-7,13H,3H2,1-2H3,(H,14,15)