2,4-bis(bromanyl)-6-[[butyl(methyl)azaniumyl]methyl]phenolate

Systemtic Name: 2,4-bis(bromanyl)-6-[[butyl(methyl)azaniumyl]methyl]phenolate Openeye Name: 2,4-dibromo-6-[[butyl(methyl)ammonio]methyl]phenolate CAS Name: 2,4-dibromo-6-[[butyl(methyl)ammonio]methyl]phenolate IUPAC Name: 2,4-dibromo-6-[[butyl(methyl)azaniumyl]methyl]phenolate Traditional Name: 2,4-dibromo-6-[[butyl(methyl)ammonio]methyl]phenolate Formula: C12H17Br2NO MolecularWeight: 351.07748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=CC(=CC(=C1[O-])Br)Br

Isomeric SMILES

CCCC[NH+](C)CC1=CC(=CC(=C1[O-])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