(4-fluorophenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium

Systemtic Name: (4-fluorophenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]azanium Openeye Name: [(1R)-2-(benzylamino)-1-methyl-2-oxo-ethyl]-[(4-fluorophenyl)methyl]-methyl-ammonium CAS Name: (4-fluorophenyl)methyl-methyl-[(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]ammonium IUPAC Name: [(2R)-1-(benzylamino)-1-oxopropan-2-yl]-[(4-fluorophenyl)methyl]-methylazanium Traditional Name: [(1R)-2-(benzylamino)-2-keto-1-methyl-ethyl]-(4-fluorobenzyl)-methyl-ammonium Formula: C18H22FN2O+ MolecularWeight: 301.378483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)F

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H21FN2O/c1-14(18(22)20-12-15-6-4-3-5-7-15)21(2)13-16-8-10-17(19)11-9-16/h3-11,14H,12-13H2,1-2H3,(H,20,22)/p+1/t14-/m1/s1