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calcium 2-(4-hydroxyphenyl)ethanoate

calcium 2-(4-hydroxyphenyl)ethanoate

Systemtic Name:calcium 2-(4-hydroxyphenyl)ethanoate
Openeye Name:calcium 2-(4-hydroxyphenyl)acetate
CAS Name:calcium 2-(4-hydroxyphenyl)acetate
IUPAC Name:calcium 2-(4-hydroxyphenyl)acetate
Traditional Name:calcium 2-(4-hydroxyphenyl)acetate
Formula: C16H14CaO6
MolecularWeight: 342.35676
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)[O-])O.C1=CC(=CC=C1CC(=O)[O-])O.[Ca+2]


Isomeric SMILES

C1=CC(=CC=C1CC(=O)[O-])O.C1=CC(=CC=C1CC(=O)[O-])O.[Ca+2]


InChI

InChI=1S/2C8H8O3.Ca/c2*9-7-3-1-6(2-4-7)5-8(10)11;/h2*1-4,9H,5H2,(H,10,11);/q;;+2/p-2


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