(3-bromanyl-4,5-dimethoxy-phenyl)methyl-(2-dimethylaminoethyl)azanium

Systemtic Name: (3-bromanyl-4,5-dimethoxy-phenyl)methyl-(2-dimethylaminoethyl)azanium Openeye Name: (3-bromo-4,5-dimethoxy-phenyl)methyl-(2-dimethylaminoethyl)ammonium CAS Name: (3-bromo-4,5-dimethoxyphenyl)methyl-(2-dimethylaminoethyl)ammonium IUPAC Name: (3-bromo-4,5-dimethoxyphenyl)methyl-(2-dimethylaminoethyl)azanium Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-(2-dimethylaminoethyl)ammonium Formula: C13H22BrN2O2+ MolecularWeight: 318.22998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC[NH2+]CC1=CC(=C(C(=C1)Br)OC)OC

Isomeric SMILES

CN(C)CC[NH2+]CC1=CC(=C(C(=C1)Br)OC)OC

InChI

InChI=1S/C13H21BrN2O2/c1-16(2)6-5-15-9-10-7-11(14)13(18-4)12(8-10)17-3/h7-8,15H,5-6,9H2,1-4H3/p+1