3-bromanyl-4,5,6-tributyl-benzene-1,2-diolate

Systemtic Name: 3-bromanyl-4,5,6-tributyl-benzene-1,2-diolate Openeye Name: 3-bromo-4,5,6-tributyl-benzene-1,2-diolate CAS Name: 3-bromo-4,5,6-tributylbenzene-1,2-diolate IUPAC Name: 3-bromo-4,5,6-tributylbenzene-1,2-diolate Traditional Name: 3-bromo-4,5,6-tributyl-benzene-1,2-diolate Formula: C18H27BrO2-2 MolecularWeight: 355.30978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C(=C1CCCC)Br)[O-])[O-])CCCC

Isomeric SMILES

CCCCC1=C(C(=C(C(=C1CCCC)Br)[O-])[O-])CCCC

InChI

InChI=1S/C18H29BrO2/c1-4-7-10-13-14(11-8-5-2)16(19)18(21)17(20)15(13)12-9-6-3/h20-21H,4-12H2,1-3H3/p-2