[3,5-bis(bromanyl)-2-oxidanyl-phenyl]methyl-bis[3-(dimethylazaniumyl)propyl]azanium

Systemtic Name: [3,5-bis(bromanyl)-2-oxidanyl-phenyl]methyl-bis[3-(dimethylazaniumyl)propyl]azanium Openeye Name: (3,5-dibromo-2-hydroxy-phenyl)methyl-bis[3-(dimethylammonio)propyl]ammonium CAS Name: (3,5-dibromo-2-hydroxyphenyl)methyl-bis[3-(dimethylammonio)propyl]ammonium IUPAC Name: (3,5-dibromo-2-hydroxyphenyl)methyl-bis[3-(dimethylazaniumyl)propyl]azanium Traditional Name: (3,5-dibromo-2-hydroxy-benzyl)-bis[3-(dimethylammonio)propyl]ammonium Formula: C17H32Br2N3O+3 MolecularWeight: 454.26348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH+](CCC[NH+](C)C)CC1=CC(=CC(=C1O)Br)Br

Isomeric SMILES

C[NH+](C)CCC[NH+](CCC[NH+](C)C)CC1=CC(=CC(=C1O)Br)Br

InChI

InChI=1S/C17H29Br2N3O/c1-20(2)7-5-9-22(10-6-8-21(3)4)13-14-11-15(18)12-16(19)17(14)23/h11-12,23H,5-10,13H2,1-4H3/p+3