(4-cyclohexyl-3-oxidanyl-phenyl)-trimethyl-azanium; N-methylcarbamate; hydroiodide

Systemtic Name: (4-cyclohexyl-3-oxidanyl-phenyl)-trimethyl-azanium; N-methylcarbamate; hydroiodide Openeye Name: (4-cyclohexyl-3-hydroxy-phenyl)-trimethyl-ammonium; N-methylcarbamate; hydroiodide CAS Name: (4-cyclohexyl-3-hydroxyphenyl)-trimethylammonium; N-methylcarbamate; hydroiodide IUPAC Name: (4-cyclohexyl-3-hydroxyphenyl)-trimethylazanium; N-methylcarbamate; hydroiodide Traditional Name: (4-cyclohexyl-3-hydroxy-phenyl)-trimethyl-ammonium; N-methylcarbamate; hydroiodide Formula: C17H29IN2O3 MolecularWeight: 436.32823

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)[O-].C[N+](C)(C)C1=CC(=C(C=C1)C2CCCCC2)O.I

Isomeric SMILES

CNC(=O)[O-].C[N+](C)(C)C1=CC(=C(C=C1)C2CCCCC2)O.I

InChI

InChI=1S/C15H23NO.C2H5NO2.HI/c1-16(2,3)13-9-10-14(15(17)11-13)12-7-5-4-6-8-12;1-3-2(4)5;/h9-12H,4-8H2,1-3H3;3H,1H3,(H,4,5);1H