trimethyl-[3-[2-[3-(phenylcarbonyl)phenyl]propanoylamino]propyl]azanium iodide

Systemtic Name: trimethyl-[3-[2-[3-(phenylcarbonyl)phenyl]propanoylamino]propyl]azanium iodide Openeye Name: 3-[2-(3-benzoylphenyl)propanoylamino]propyl-trimethyl-ammonium iodide CAS Name: 3-[[2-(3-benzoylphenyl)-1-oxopropyl]amino]propyl-trimethylammonium iodide IUPAC Name: 3-[2-(3-benzoylphenyl)propanoylamino]propyl-trimethylazanium iodide Traditional Name: 3-[2-(3-benzoylphenyl)propanoylamino]propyl-trimethyl-ammonium iodide Formula: C22H29IN2O2 MolecularWeight: 480.38233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O2.HI/c1-17(22(26)23-14-9-15-24(2,3)4)19-12-8-13-20(16-19)21(25)18-10-6-5-7-11-18;/h5-8,10-13,16-17H,9,14-15H2,1-4H3;1H