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

Systemtic Name: 3-(1-bromanylbutan-2-yl)benzene-1,2-diolate Openeye Name: 3-[1-(bromomethyl)propyl]benzene-1,2-diolate CAS Name: 3-(1-bromobutan-2-yl)benzene-1,2-diolate IUPAC Name: 3-(1-bromobutan-2-yl)benzene-1,2-diolate Traditional Name: 3-[1-(bromomethyl)propyl]benzene-1,2-diolate Formula: C10H11BrO2-2 MolecularWeight: 243.09714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CBr)C1=C(C(=CC=C1)[O-])[O-]

Isomeric SMILES

CCC(CBr)C1=C(C(=CC=C1)[O-])[O-]

InChI

InChI=1S/C10H13BrO2/c1-2-7(6-11)8-4-3-5-9(12)10(8)13/h3-5,7,12-13H,2,6H2,1H3/p-2