N,N-dimethylcarbamate; 3-(4-methyl-3-oxidanyl-phenyl)pentan-3-ylazanium; hydroiodide

Systemtic Name: N,N-dimethylcarbamate; 3-(4-methyl-3-oxidanyl-phenyl)pentan-3-ylazanium; hydroiodide Openeye Name: N,N-dimethylcarbamate; [1-ethyl-1-(3-hydroxy-4-methyl-phenyl)propyl]ammonium; hydroiodide CAS Name: N,N-dimethylcarbamate; 3-(3-hydroxy-4-methylphenyl)pentan-3-ylammonium; hydroiodide IUPAC Name: N,N-dimethylcarbamate; 3-(3-hydroxy-4-methylphenyl)pentan-3-ylazanium; hydroiodide Traditional Name: N,N-dimethylcarbamate; [1-ethyl-1-(3-hydroxy-4-methyl-phenyl)propyl]ammonium; hydroiodide Formula: C15H27IN2O3 MolecularWeight: 410.29095

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)C)O)[NH3+].CN(C)C(=O)[O-].I

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)C)O)[NH3+].CN(C)C(=O)[O-].I

InChI

InChI=1S/C12H19NO.C3H7NO2.HI/c1-4-12(13,5-2)10-7-6-9(3)11(14)8-10;1-4(2)3(5)6;/h6-8,14H,4-5,13H2,1-3H3;1-2H3,(H,5,6);1H