1-[4-(chloromethyl)-2,5-dimethoxy-phenyl]propan-2-ylazanium chloride

Systemtic Name: 1-[4-(chloromethyl)-2,5-dimethoxy-phenyl]propan-2-ylazanium chloride Openeye Name: [2-[4-(chloromethyl)-2,5-dimethoxy-phenyl]-1-methyl-ethyl]ammonium chloride CAS Name: 1-[4-(chloromethyl)-2,5-dimethoxyphenyl]propan-2-ylammonium chloride IUPAC Name: 1-[4-(chloromethyl)-2,5-dimethoxyphenyl]propan-2-ylazanium chloride Traditional Name: [2-[4-(chloromethyl)-2,5-dimethoxy-phenyl]-1-methyl-ethyl]ammonium chloride Formula: C12H19Cl2NO2 MolecularWeight: 280.19076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1OC)CCl)OC)[NH3+].[Cl-]

Isomeric SMILES

CC(CC1=CC(=C(C=C1OC)CCl)OC)[NH3+].[Cl-]

InChI

InChI=1S/C12H18ClNO2.ClH/c1-8(14)4-9-5-12(16-3)10(7-13)6-11(9)15-2;/h5-6,8H,4,7,14H2,1-3H3;1H