[3,5-bis(bromanyl)-2-ethoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [3,5-bis(bromanyl)-2-ethoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (3,5-dibromo-2-ethoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (3,5-dibromo-2-ethoxyphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (3,5-dibromo-2-ethoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (3,5-dibromo-2-ethoxy-benzyl)-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C16H26Br2N2O2+2 MolecularWeight: 438.19784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C[NH2+]CCC[NH+]2CCOCC2)Br)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1C[NH2+]CCC[NH+]2CCOCC2)Br)Br

InChI

InChI=1S/C16H24Br2N2O2/c1-2-22-16-13(10-14(17)11-15(16)18)12-19-4-3-5-20-6-8-21-9-7-20/h10-11,19H,2-9,12H2,1H3/p+2