3-[(4-bromophenyl)carbamoylamino]propyl-[2-(4-chlorophenyl)ethyl]-diethyl-azanium iodide

Systemtic Name: 3-[(4-bromophenyl)carbamoylamino]propyl-[2-(4-chlorophenyl)ethyl]-diethyl-azanium iodide Openeye Name: 3-[(4-bromophenyl)carbamoylamino]propyl-[2-(4-chlorophenyl)ethyl]-diethyl-ammonium iodide CAS Name: 3-[[(4-bromoanilino)-oxomethyl]amino]propyl-[2-(4-chlorophenyl)ethyl]-diethylammonium iodide IUPAC Name: 3-[(4-bromophenyl)carbamoylamino]propyl-[2-(4-chlorophenyl)ethyl]-diethylazanium iodide Traditional Name: 3-[(4-bromophenyl)carbamoylamino]propyl-[2-(4-chlorophenyl)ethyl]-diethyl-ammonium iodide Formula: C22H30BrClIN3O MolecularWeight: 594.75457

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29BrClN3O.HI/c1-3-27(4-2,17-14-18-6-10-20(24)11-7-18)16-5-15-25-22(28)26-21-12-8-19(23)9-13-21;/h6-13H,3-5,14-17H2,1-2H3,(H-,25,26,28);1H