[[2-bromanyl-4-(2-naphthalen-1-ylethoxymethyl)phenyl]-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [[2-bromanyl-4-(2-naphthalen-1-ylethoxymethyl)phenyl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[2-bromo-4-[2-(1-naphthyl)ethoxymethyl]phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[2-bromo-4-[2-(1-naphthalenyl)ethoxymethyl]phenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[2-bromo-4-(2-naphthalen-1-ylethoxymethyl)phenyl]-difluoromethyl]phosphonic acid Traditional Name: [[2-bromo-4-[2-(1-naphthyl)ethoxymethyl]phenyl]-difluoro-methyl]phosphonic acid Formula: C20H18BrF2O4P MolecularWeight: 471.229087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CCOCC3=CC(=C(C=C3)C(F)(F)P(=O)(O)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CCOCC3=CC(=C(C=C3)C(F)(F)P(=O)(O)O)Br

InChI

InChI=1S/C20H18BrF2O4P/c21-19-12-14(8-9-18(19)20(22,23)28(24,25)26)13-27-11-10-16-6-3-5-15-4-1-2-7-17(15)16/h1-9,12H,10-11,13H2,(H2,24,25,26)