(3-bromanyl-4,5-diethoxy-phenyl)methyl-[3-(methylazaniumyl)propyl]azanium

Systemtic Name: (3-bromanyl-4,5-diethoxy-phenyl)methyl-[3-(methylazaniumyl)propyl]azanium Openeye Name: (3-bromo-4,5-diethoxy-phenyl)methyl-[3-(methylammonio)propyl]ammonium CAS Name: (3-bromo-4,5-diethoxyphenyl)methyl-[3-(methylammonio)propyl]ammonium IUPAC Name: (3-bromo-4,5-diethoxyphenyl)methyl-[3-(methylazaniumyl)propyl]azanium Traditional Name: (3-bromo-4,5-diethoxy-benzyl)-[3-(methylammonio)propyl]ammonium Formula: C15H27BrN2O2+2 MolecularWeight: 347.29108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCC[NH2+]C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCC[NH2+]C)Br)OCC

InChI

InChI=1S/C15H25BrN2O2/c1-4-19-14-10-12(11-18-8-6-7-17-3)9-13(16)15(14)20-5-2/h9-10,17-18H,4-8,11H2,1-3H3/p+2