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calcium 3-bromanylpyridine-2,6-dicarboxylate

calcium 3-bromanylpyridine-2,6-dicarboxylate

Systemtic Name:calcium 3-bromanylpyridine-2,6-dicarboxylate
Openeye Name:calcium 3-bromopyridine-2,6-dicarboxylate
CAS Name:calcium 3-bromopyridine-2,6-dicarboxylate
IUPAC Name:calcium 3-bromopyridine-2,6-dicarboxylate
Traditional Name:calcium 3-bromodipicolinate
Formula: C7H2BrCaNO4
MolecularWeight: 284.07708
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1Br)C(=O)[O-])C(=O)[O-].[Ca+2]


Isomeric SMILES

C1=CC(=NC(=C1Br)C(=O)[O-])C(=O)[O-].[Ca+2]


InChI

InChI=1S/C7H4BrNO4.Ca/c8-3-1-2-4(6(10)11)9-5(3)7(12)13;/h1-2H,(H,10,11)(H,12,13);/q;+2/p-2


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