[2-(3,4-dichlorophenyl)carbonyloxy-2-phenyl-ethyl]-diethyl-methyl-azanium iodide

Systemtic Name: [2-(3,4-dichlorophenyl)carbonyloxy-2-phenyl-ethyl]-diethyl-methyl-azanium iodide Openeye Name: [2-(3,4-dichlorobenzoyl)oxy-2-phenyl-ethyl]-diethyl-methyl-ammonium iodide CAS Name: [2-[(3,4-dichlorophenyl)-oxomethoxy]-2-phenylethyl]-diethyl-methylammonium iodide IUPAC Name: [2-(3,4-dichlorobenzoyl)oxy-2-phenylethyl]-diethyl-methylazanium iodide Traditional Name: [2-(3,4-dichlorobenzoyl)oxy-2-phenyl-ethyl]-diethyl-methyl-ammonium iodide Formula: C20H24Cl2INO2 MolecularWeight: 508.22053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Cl)Cl.[I-]

Isomeric SMILES

CC[N+](C)(CC)CC(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Cl)Cl.[I-]

InChI

InChI=1S/C20H24Cl2NO2.HI/c1-4-23(3,5-2)14-19(15-9-7-6-8-10-15)25-20(24)16-11-12-17(21)18(22)13-16;/h6-13,19H,4-5,14H2,1-3H3;1H/q+1;/p-1