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

Systemtic Name: [3,5-bis(bromanyl)-2-oxidanyl-phenyl]methyl-butyl-methyl-azanium Openeye Name: butyl-[(3,5-dibromo-2-hydroxy-phenyl)methyl]-methyl-ammonium CAS Name: butyl-[(3,5-dibromo-2-hydroxyphenyl)methyl]-methylammonium IUPAC Name: butyl-[(3,5-dibromo-2-hydroxyphenyl)methyl]-methylazanium Traditional Name: butyl-(3,5-dibromo-2-hydroxy-benzyl)-methyl-ammonium Formula: C12H18Br2NO+ MolecularWeight: 352.08542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17Br2NO/c1-3-4-5-15(2)8-9-6-10(13)7-11(14)12(9)16/h6-7,16H,3-5,8H2,1-2H3/p+1