3-[3-[bis(2-fluoranylethyl)amino]phenyl]propanoic acid

Systemtic Name: 3-[3-[bis(2-fluoranylethyl)amino]phenyl]propanoic acid Openeye Name: 3-[3-[bis(2-fluoroethyl)amino]phenyl]propanoic acid CAS Name: 3-[3-[bis(2-fluoroethyl)amino]phenyl]propanoic acid IUPAC Name: 3-[3-[bis(2-fluoroethyl)amino]phenyl]propanoic acid Traditional Name: 3-[3-[bis(2-fluoroethyl)amino]phenyl]propionic acid Formula: C13H17F2NO2 MolecularWeight: 257.276386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(CCF)CCF)CCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N(CCF)CCF)CCC(=O)O

InChI

InChI=1S/C13H17F2NO2/c14-6-8-16(9-7-15)12-3-1-2-11(10-12)4-5-13(17)18/h1-3,10H,4-9H2,(H,17,18)