[4-[(2,6-dimethylphenoxy)methyl]-3-fluoranyl-phenyl]methylazanium

Systemtic Name: [4-[(2,6-dimethylphenoxy)methyl]-3-fluoranyl-phenyl]methylazanium Openeye Name: [4-[(2,6-dimethylphenoxy)methyl]-3-fluoro-phenyl]methylammonium CAS Name: [4-[(2,6-dimethylphenoxy)methyl]-3-fluorophenyl]methylammonium IUPAC Name: [4-[(2,6-dimethylphenoxy)methyl]-3-fluorophenyl]methylazanium Traditional Name: [4-[(2,6-dimethylphenoxy)methyl]-3-fluoro-benzyl]ammonium Formula: C16H19FNO+ MolecularWeight: 260.326563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2=C(C=C(C=C2)C[NH3+])F

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2=C(C=C(C=C2)C[NH3+])F

InChI

InChI=1S/C16H18FNO/c1-11-4-3-5-12(2)16(11)19-10-14-7-6-13(9-18)8-15(14)17/h3-8H,9-10,18H2,1-2H3/p+1