diethyl-[2-[2-ethylsulfanyl-2-(4-fluorophenyl)-2-phenyl-ethanoyl]oxyethyl]-methyl-azanium iodide

Systemtic Name: diethyl-[2-[2-ethylsulfanyl-2-(4-fluorophenyl)-2-phenyl-ethanoyl]oxyethyl]-methyl-azanium iodide Openeye Name: diethyl-[2-[2-ethylsulfanyl-2-(4-fluorophenyl)-2-phenyl-acetyl]oxyethyl]-methyl-ammonium iodide CAS Name: diethyl-[2-[2-(ethylthio)-2-(4-fluorophenyl)-1-oxo-2-phenylethoxy]ethyl]-methylammonium iodide IUPAC Name: diethyl-[2-[2-ethylsulfanyl-2-(4-fluorophenyl)-2-phenylacetyl]oxyethyl]-methylazanium iodide Traditional Name: diethyl-[2-[2-(ethylthio)-2-(4-fluorophenyl)-2-phenyl-acetyl]oxyethyl]-methyl-ammonium iodide Formula: C23H31FINO2S MolecularWeight: 531.465613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=C(C=C2)F)SCC.[I-]

Isomeric SMILES

CC[N+](C)(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=C(C=C2)F)SCC.[I-]

InChI

InChI=1S/C23H31FNO2S.HI/c1-5-25(4,6-2)17-18-27-22(26)23(28-7-3,19-11-9-8-10-12-19)20-13-15-21(24)16-14-20;/h8-16H,5-7,17-18H2,1-4H3;1H/q+1;/p-1