2-(4-chlorophenyl)ethyl-diethyl-[5-(phenylcarbamoylamino)pentyl]azanium iodide

Systemtic Name: 2-(4-chlorophenyl)ethyl-diethyl-[5-(phenylcarbamoylamino)pentyl]azanium iodide Openeye Name: 2-(4-chlorophenyl)ethyl-diethyl-[5-(phenylcarbamoylamino)pentyl]ammonium iodide CAS Name: 5-[[anilino(oxo)methyl]amino]pentyl-[2-(4-chlorophenyl)ethyl]-diethylammonium iodide IUPAC Name: 2-(4-chlorophenyl)ethyl-diethyl-[5-(phenylcarbamoylamino)pentyl]azanium iodide Traditional Name: 2-(4-chlorophenyl)ethyl-diethyl-[5-(phenylcarbamoylamino)pentyl]ammonium iodide Formula: C24H35ClIN3O MolecularWeight: 543.91167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCCNC(=O)NC1=CC=CC=C1)CCC2=CC=C(C=C2)Cl.[I-]

Isomeric SMILES

CC[N+](CC)(CCCCCNC(=O)NC1=CC=CC=C1)CCC2=CC=C(C=C2)Cl.[I-]

InChI

InChI=1S/C24H34ClN3O.HI/c1-3-28(4-2,20-17-21-13-15-22(25)16-14-21)19-10-6-9-18-26-24(29)27-23-11-7-5-8-12-23;/h5,7-8,11-16H,3-4,6,9-10,17-20H2,1-2H3,(H-,26,27,29);1H