3-(4-hydroxyphenyl)propyl-trimethyl-azanium; N-methylcarbamate; hydroiodide

Systemtic Name: 3-(4-hydroxyphenyl)propyl-trimethyl-azanium; N-methylcarbamate; hydroiodide Openeye Name: 3-(4-hydroxyphenyl)propyl-trimethyl-ammonium; N-methylcarbamate; hydroiodide CAS Name: 3-(4-hydroxyphenyl)propyl-trimethylammonium; N-methylcarbamate; hydroiodide IUPAC Name: 3-(4-hydroxyphenyl)propyl-trimethylazanium; N-methylcarbamate; hydroiodide Traditional Name: 3-(4-hydroxyphenyl)propyl-trimethyl-ammonium; N-methylcarbamate; hydroiodide Formula: C14H25IN2O3 MolecularWeight: 396.26437

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)[O-].C[N+](C)(C)CCCC1=CC=C(C=C1)O.I

Isomeric SMILES

CNC(=O)[O-].C[N+](C)(C)CCCC1=CC=C(C=C1)O.I

InChI

InChI=1S/C12H19NO.C2H5NO2.HI/c1-13(2,3)10-4-5-11-6-8-12(14)9-7-11;1-3-2(4)5;/h6-9H,4-5,10H2,1-3H3;3H,1H3,(H,4,5);1H