4-(3-hydroxyphenyl)butan-2-yl-trimethyl-azanium iodide

Systemtic Name: 4-(3-hydroxyphenyl)butan-2-yl-trimethyl-azanium iodide Openeye Name: [3-(3-hydroxyphenyl)-1-methyl-propyl]-trimethyl-ammonium iodide CAS Name: 4-(3-hydroxyphenyl)butan-2-yl-trimethylammonium iodide IUPAC Name: 4-(3-hydroxyphenyl)butan-2-yl-trimethylazanium iodide Traditional Name: [3-(3-hydroxyphenyl)-1-methyl-propyl]-trimethyl-ammonium iodide Formula: C13H22INO MolecularWeight: 335.22435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=CC=C1)O)[N+](C)(C)C.[I-]

Isomeric SMILES

CC(CCC1=CC(=CC=C1)O)[N+](C)(C)C.[I-]

InChI

InChI=1S/C13H21NO.HI/c1-11(14(2,3)4)8-9-12-6-5-7-13(15)10-12;/h5-7,10-11H,8-9H2,1-4H3;1H