[2-[4-(dimethylamino)-3-propan-2-yl-phenoxy]-2-oxidanylidene-ethyl]-trimethyl-azanium iodide

Systemtic Name: [2-[4-(dimethylamino)-3-propan-2-yl-phenoxy]-2-oxidanylidene-ethyl]-trimethyl-azanium iodide Openeye Name: [2-[4-(dimethylamino)-3-isopropyl-phenoxy]-2-oxo-ethyl]-trimethyl-ammonium iodide CAS Name: [2-[4-(dimethylamino)-3-propan-2-ylphenoxy]-2-oxoethyl]-trimethylammonium iodide IUPAC Name: [2-[4-(dimethylamino)-3-propan-2-ylphenoxy]-2-oxoethyl]-trimethylazanium iodide Traditional Name: [2-[4-(dimethylamino)-3-isopropyl-phenoxy]-2-keto-ethyl]-trimethyl-ammonium iodide Formula: C16H27IN2O2 MolecularWeight: 406.30225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N2O2.HI/c1-12(2)14-10-13(8-9-15(14)17(3)4)20-16(19)11-18(5,6)7;/h8-10,12H,11H2,1-7H3;1H/q+1;/p-1