calcium 2-(4-hydroxyphenyl)-2-oxidanyl-ethanoate

Systemtic Name: calcium 2-(4-hydroxyphenyl)-2-oxidanyl-ethanoate Openeye Name: calcium 2-hydroxy-2-(4-hydroxyphenyl)acetate CAS Name: calcium 2-hydroxy-2-(4-hydroxyphenyl)acetate IUPAC Name: calcium 2-hydroxy-2-(4-hydroxyphenyl)acetate Traditional Name: calcium 2-hydroxy-2-(4-hydroxyphenyl)acetate Formula: C8H7CaO4+ MolecularWeight: 207.21678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(=O)[O-])O)O.[Ca+2]

Isomeric SMILES

C1=CC(=CC=C1C(C(=O)[O-])O)O.[Ca+2]

InChI

InChI=1S/C8H8O4.Ca/c9-6-3-1-5(2-4-6)7(10)8(11)12;/h1-4,7,9-10H,(H,11,12);/q;+2/p-1