dimethyl-[2-oxidanyl-3-(2-phenylphenoxy)propyl]-propan-2-yl-azanium iodide

Systemtic Name: dimethyl-[2-oxidanyl-3-(2-phenylphenoxy)propyl]-propan-2-yl-azanium iodide Openeye Name: [2-hydroxy-3-(2-phenylphenoxy)propyl]-isopropyl-dimethyl-ammonium iodide CAS Name: [2-hydroxy-3-(2-phenylphenoxy)propyl]-dimethyl-propan-2-ylammonium iodide IUPAC Name: [2-hydroxy-3-(2-phenylphenoxy)propyl]-dimethyl-propan-2-ylazanium iodide Traditional Name: [2-hydroxy-3-(2-phenylphenoxy)propyl]-isopropyl-dimethyl-ammonium iodide Formula: C20H28INO2 MolecularWeight: 441.34629

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(C)CC(COC1=CC=CC=C1C2=CC=CC=C2)O.[I-]

Isomeric SMILES

CC(C)[N+](C)(C)CC(COC1=CC=CC=C1C2=CC=CC=C2)O.[I-]

InChI

InChI=1S/C20H28NO2.HI/c1-16(2)21(3,4)14-18(22)15-23-20-13-9-8-12-19(20)17-10-6-5-7-11-17;/h5-13,16,18,22H,14-15H2,1-4H3;1H/q+1;/p-1