[(1S)-1-[3-[2-(2-methylphenyl)ethanoylamino]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[3-[2-(2-methylphenyl)ethanoylamino]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[3-[[2-(o-tolyl)acetyl]amino]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[3-[[2-(2-methylphenyl)-1-oxoethyl]amino]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[3-[[2-(2-methylphenyl)acetyl]amino]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[3-[[2-(o-tolyl)acetyl]amino]phenyl]ethyl]ammonium Formula: C17H21N2O+ MolecularWeight: 269.36144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=CC=CC(=C2)C(C)[NH3+]

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=CC=CC(=C2)[C@H](C)[NH3+]

InChI

InChI=1S/C17H20N2O/c1-12-6-3-4-7-14(12)11-17(20)19-16-9-5-8-15(10-16)13(2)18/h3-10,13H,11,18H2,1-2H3,(H,19,20)/p+1/t13-/m0/s1