(3-chlorophenyl)methyl-methyl-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: (3-chlorophenyl)methyl-methyl-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl]-[(3-chlorophenyl)methyl]-methyl-ammonium CAS Name: [(2S)-1-anilino-1-oxopropan-2-yl]-[(3-chlorophenyl)methyl]-methylammonium IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl]-[(3-chlorophenyl)methyl]-methylazanium Traditional Name: [(1S)-2-anilino-2-keto-1-methyl-ethyl]-(3-chlorobenzyl)-methyl-ammonium Formula: C17H20ClN2O+ MolecularWeight: 303.8065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+](C)CC2=CC(=CC=C2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)[NH+](C)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H19ClN2O/c1-13(17(21)19-16-9-4-3-5-10-16)20(2)12-14-7-6-8-15(18)11-14/h3-11,13H,12H2,1-2H3,(H,19,21)/p+1/t13-/m0/s1