calcium 2-(3-fluoranyl-4-phenyl-phenyl)propanoic acid

Systemtic Name: calcium 2-(3-fluoranyl-4-phenyl-phenyl)propanoic acid Openeye Name: calcium 2-(3-fluoro-4-phenyl-phenyl)propanoic acid CAS Name: calcium 2-(3-fluoro-4-phenylphenyl)propanoic acid IUPAC Name: calcium 2-(3-fluoro-4-phenylphenyl)propanoic acid Traditional Name: calcium 2-(3-fluoro-4-phenyl-phenyl)propionic acid Formula: C15H13CaFO2+2 MolecularWeight: 284.338923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O.[Ca+2]

Isomeric SMILES

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O.[Ca+2]

InChI

InChI=1S/C15H13FO2.Ca/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11;/h2-10H,1H3,(H,17,18);/q;+2