2-[butanoyl(methyl)amino]-3-fluoranyl-benzoate

Systemtic Name: 2-[butanoyl(methyl)amino]-3-fluoranyl-benzoate Openeye Name: 2-[butanoyl(methyl)amino]-3-fluoro-benzoate CAS Name: 3-fluoro-2-[methyl(1-oxobutyl)amino]benzoate IUPAC Name: 2-[butanoyl(methyl)amino]-3-fluorobenzoate Traditional Name: 2-[butyryl(methyl)amino]-3-fluoro-benzoate Formula: C12H13FNO3- MolecularWeight: 238.234923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C)C1=C(C=CC=C1F)C(=O)[O-]

Isomeric SMILES

CCCC(=O)N(C)C1=C(C=CC=C1F)C(=O)[O-]

InChI

InChI=1S/C12H14FNO3/c1-3-5-10(15)14(2)11-8(12(16)17)6-4-7-9(11)13/h4,6-7H,3,5H2,1-2H3,(H,16,17)/p-1