2-[2-cyanoethyl(methyl)amino]-5-fluoranyl-benzoic acid

Systemtic Name: 2-[2-cyanoethyl(methyl)amino]-5-fluoranyl-benzoic acid Openeye Name: 2-[2-cyanoethyl(methyl)amino]-5-fluoro-benzoic acid CAS Name: 2-[2-cyanoethyl(methyl)amino]-5-fluorobenzoic acid IUPAC Name: 2-[2-cyanoethyl(methyl)amino]-5-fluorobenzoic acid Traditional Name: 2-[2-cyanoethyl(methyl)amino]-5-fluoro-benzoic acid Formula: C11H11FN2O2 MolecularWeight: 222.215643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=C(C=C(C=C1)F)C(=O)O

Isomeric SMILES

CN(CCC#N)C1=C(C=C(C=C1)F)C(=O)O

InChI

InChI=1S/C11H11FN2O2/c1-14(6-2-5-13)10-4-3-8(12)7-9(10)11(15)16/h3-4,7H,2,6H2,1H3,(H,15,16)