3-(3-bromanylhexan-2-yl)benzene-1,2-diolate

Systemtic Name: 3-(3-bromanylhexan-2-yl)benzene-1,2-diolate Openeye Name: 3-(2-bromo-1-methyl-pentyl)benzene-1,2-diolate CAS Name: 3-(3-bromohexan-2-yl)benzene-1,2-diolate IUPAC Name: 3-(3-bromohexan-2-yl)benzene-1,2-diolate Traditional Name: 3-(2-bromo-1-methyl-pentyl)benzene-1,2-diolate Formula: C12H15BrO2-2 MolecularWeight: 271.1503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrO2/c1-3-5-10(13)8(2)9-6-4-7-11(14)12(9)15/h4,6-8,10,14-15H,3,5H2,1-2H3/p-2