[3,5-bis(bromanyl)-2-ethoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [3,5-bis(bromanyl)-2-ethoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: (3,5-dibromo-2-ethoxy-phenyl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (3,5-dibromo-2-ethoxyphenyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (3,5-dibromo-2-ethoxyphenyl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (3,5-dibromo-2-ethoxy-benzyl)-(3-imidazol-1-ylpropyl)ammonium Formula: C15H20Br2N3O+ MolecularWeight: 418.1468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C[NH2+]CCCN2C=CN=C2)Br)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1C[NH2+]CCCN2C=CN=C2)Br)Br

InChI

InChI=1S/C15H19Br2N3O/c1-2-21-15-12(8-13(16)9-14(15)17)10-18-4-3-6-20-7-5-19-11-20/h5,7-9,11,18H,2-4,6,10H2,1H3/p+1