[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-dimethyl-(naphthalen-1-ylmethyl)azanium iodide

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-dimethyl-(naphthalen-1-ylmethyl)azanium iodide Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl]-dimethyl-(1-naphthylmethyl)ammonium iodide CAS Name: [2-(4-chlorophenyl)-2-oxoethyl]-dimethyl-(1-naphthalenylmethyl)ammonium iodide IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl]-dimethyl-(naphthalen-1-ylmethyl)azanium iodide Traditional Name: [2-(4-chlorophenyl)-2-keto-ethyl]-dimethyl-(1-naphthylmethyl)ammonium iodide Formula: C21H21ClINO MolecularWeight: 465.75501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=CC2=CC=CC=C21)CC(=O)C3=CC=C(C=C3)Cl.[I-]

Isomeric SMILES

C[N+](C)(CC1=CC=CC2=CC=CC=C21)CC(=O)C3=CC=C(C=C3)Cl.[I-]

InChI

InChI=1S/C21H21ClNO.HI/c1-23(2,15-21(24)17-10-12-19(22)13-11-17)14-18-8-5-7-16-6-3-4-9-20(16)18;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1