(5-bromanyl-2-methoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (5-bromo-2-methoxy-benzyl)-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C15H25BrN2O2+2 MolecularWeight: 345.2752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH2+]CCC[NH+]2CCOCC2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH2+]CCC[NH+]2CCOCC2

InChI

InChI=1S/C15H23BrN2O2/c1-19-15-4-3-14(16)11-13(15)12-17-5-2-6-18-7-9-20-10-8-18/h3-4,11,17H,2,5-10,12H2,1H3/p+2