2-[3-[[(4-fluorophenyl)amino]methyl]phenoxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[[(4-fluorophenyl)amino]methyl]phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[3-[(4-fluoroanilino)methyl]phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[3-[(4-fluoroanilino)methyl]phenoxy]ethyl-dimethylammonium IUPAC Name: 2-[3-[(4-fluoroanilino)methyl]phenoxy]ethyl-dimethylazanium Traditional Name: 2-[3-[(4-fluoroanilino)methyl]phenoxy]ethyl-dimethyl-ammonium Formula: C17H22FN2O+ MolecularWeight: 289.367783

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=CC(=C1)CNC2=CC=C(C=C2)F

Isomeric SMILES

C[NH+](C)CCOC1=CC=CC(=C1)CNC2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN2O/c1-20(2)10-11-21-17-5-3-4-14(12-17)13-19-16-8-6-15(18)7-9-16/h3-9,12,19H,10-11,13H2,1-2H3/p+1