2-[4,5-dimethoxy-2-[(Z)-N-oxidanyl-C-phenyl-carbonimidoyl]phenyl]ethyl-trimethyl-azanium iodide

Systemtic Name: 2-[4,5-dimethoxy-2-[(Z)-N-oxidanyl-C-phenyl-carbonimidoyl]phenyl]ethyl-trimethyl-azanium iodide Openeye Name: 2-[2-[(Z)-N-hydroxy-C-phenyl-carbonimidoyl]-4,5-dimethoxy-phenyl]ethyl-trimethyl-ammonium iodide CAS Name: 2-[2-[(Z)-hydroxyimino(phenyl)methyl]-4,5-dimethoxyphenyl]ethyl-trimethylammonium iodide IUPAC Name: 2-[2-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]-4,5-dimethoxyphenyl]ethyl-trimethylazanium iodide Traditional Name: 2-[4,5-dimethoxy-2-[(Z)-phenylcarbohydroximoyl]phenyl]ethyl-trimethyl-ammonium iodide Formula: C20H27IN2O3 MolecularWeight: 470.34445

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC1=CC(=C(C=C1C(=NO)C2=CC=CC=C2)OC)OC.[I-]

Isomeric SMILES

C[N+](C)(C)CCC1=CC(=C(C=C1/C(=N\O)/C2=CC=CC=C2)OC)OC.[I-]

InChI

InChI=1S/C20H26N2O3.HI/c1-22(2,3)12-11-16-13-18(24-4)19(25-5)14-17(16)20(21-23)15-9-7-6-8-10-15;/h6-10,13-14H,11-12H2,1-5H3;1H/b21-20-;