3-[(4-chlorophenyl)carbamoylamino]propyl-trimethyl-azanium iodide

Systemtic Name: 3-[(4-chlorophenyl)carbamoylamino]propyl-trimethyl-azanium iodide Openeye Name: 3-[(4-chlorophenyl)carbamoylamino]propyl-trimethyl-ammonium iodide CAS Name: 3-[[(4-chloroanilino)-oxomethyl]amino]propyl-trimethylammonium iodide IUPAC Name: 3-[(4-chlorophenyl)carbamoylamino]propyl-trimethylazanium iodide Traditional Name: 3-[(4-chlorophenyl)carbamoylamino]propyl-trimethyl-ammonium iodide Formula: C13H21ClIN3O MolecularWeight: 397.68281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClN3O.HI/c1-17(2,3)10-4-9-15-13(18)16-12-7-5-11(14)6-8-12;/h5-8H,4,9-10H2,1-3H3,(H-,15,16,18);1H