calcium 2-[(2-oxidanidyl-5-phenyl-phenyl)methyl]-4-phenyl-phenolate

Systemtic Name: calcium 2-[(2-oxidanidyl-5-phenyl-phenyl)methyl]-4-phenyl-phenolate Openeye Name: calcium 2-[(2-oxido-5-phenyl-phenyl)methyl]-4-phenyl-phenolate CAS Name: calcium 2-[(2-oxido-5-phenylphenyl)methyl]-4-phenylphenolate IUPAC Name: calcium 2-[(2-oxido-5-phenylphenyl)methyl]-4-phenylphenolate Traditional Name: calcium 2-(2-oxido-5-phenyl-benzyl)-4-phenyl-phenolate Formula: C25H18CaO2 MolecularWeight: 390.48722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)[O-])CC3=C(C=CC(=C3)C4=CC=CC=C4)[O-].[Ca+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)[O-])CC3=C(C=CC(=C3)C4=CC=CC=C4)[O-].[Ca+2]

InChI

InChI=1S/C25H20O2.Ca/c26-24-13-11-20(18-7-3-1-4-8-18)15-22(24)17-23-16-21(12-14-25(23)27)19-9-5-2-6-10-19;/h1-16,26-27H,17H2;/q;+2/p-2