4,5-bis(bromanyl)-3-butyl-benzene-1,2-diolate

Systemtic Name: 4,5-bis(bromanyl)-3-butyl-benzene-1,2-diolate Openeye Name: 4,5-dibromo-3-butyl-benzene-1,2-diolate CAS Name: 4,5-dibromo-3-butylbenzene-1,2-diolate IUPAC Name: 4,5-dibromo-3-butylbenzene-1,2-diolate Traditional Name: 4,5-dibromo-3-butyl-benzene-1,2-diolate Formula: C10H10Br2O2-2 MolecularWeight: 321.9932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC(=C1Br)Br)[O-])[O-]

Isomeric SMILES

CCCCC1=C(C(=CC(=C1Br)Br)[O-])[O-]

InChI

InChI=1S/C10H12Br2O2/c1-2-3-4-6-9(12)7(11)5-8(13)10(6)14/h5,13-14H,2-4H2,1H3/p-2