(3-methoxy-4-pent-4-enoxy-phenyl)azanium bromide

Systemtic Name: (3-methoxy-4-pent-4-enoxy-phenyl)azanium bromide Openeye Name: (3-methoxy-4-pent-4-enoxy-phenyl)ammonium bromide CAS Name: (3-methoxy-4-pent-4-enoxyphenyl)ammonium bromide IUPAC Name: (3-methoxy-4-pent-4-enoxyphenyl)azanium bromide Traditional Name: (3-methoxy-4-pent-4-enoxy-phenyl)ammonium bromide Formula: C12H18BrNO2 MolecularWeight: 288.18082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[NH3+])OCCCC=C.[Br-]

Isomeric SMILES

COC1=C(C=CC(=C1)[NH3+])OCCCC=C.[Br-]

InChI

InChI=1S/C12H17NO2.BrH/c1-3-4-5-8-15-11-7-6-10(13)9-12(11)14-2;/h3,6-7,9H,1,4-5,8,13H2,2H3;1H