(4-fluorophenyl)methyl-[[3-[(4-methylphenyl)carbonylamino]phenyl]methyl]azanium

Systemtic Name: (4-fluorophenyl)methyl-[[3-[(4-methylphenyl)carbonylamino]phenyl]methyl]azanium Openeye Name: (4-fluorophenyl)methyl-[[3-[(4-methylbenzoyl)amino]phenyl]methyl]ammonium CAS Name: (4-fluorophenyl)methyl-[[3-[[(4-methylphenyl)-oxomethyl]amino]phenyl]methyl]ammonium IUPAC Name: (4-fluorophenyl)methyl-[[3-[(4-methylbenzoyl)amino]phenyl]methyl]azanium Traditional Name: (4-fluorobenzyl)-[3-(p-toluoylamino)benzyl]ammonium Formula: C22H22FN2O+ MolecularWeight: 349.421283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C[NH2+]CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C[NH2+]CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2O/c1-16-5-9-19(10-6-16)22(26)25-21-4-2-3-18(13-21)15-24-14-17-7-11-20(23)12-8-17/h2-13,24H,14-15H2,1H3,(H,25,26)/p+1