3,5-bis(phenylmethoxy)benzoate; terbium(3+)

Systemtic Name: 3,5-bis(phenylmethoxy)benzoate; terbium(3+) Openeye Name: 3,5-dibenzyloxybenzoate; terbium(3+) CAS Name: 3,5-bis(phenylmethoxy)benzoate; terbium(3+) IUPAC Name: 3,5-bis(phenylmethoxy)benzoate; terbium(3+) Traditional Name: 3,5-dibenzoxybenzoate; terbium(3+) Formula: C63H51O12Tb MolecularWeight: 1158.99718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)[O-])OCC3=CC=CC=C3.C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)[O-])OCC3=CC=CC=C3.C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)[O-])OCC3=CC=CC=C3.[Tb+3]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)[O-])OCC3=CC=CC=C3.C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)[O-])OCC3=CC=CC=C3.C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)[O-])OCC3=CC=CC=C3.[Tb+3]

InChI

InChI=1S/3C21H18O4.Tb/c3*22-21(23)18-11-19(24-14-16-7-3-1-4-8-16)13-20(12-18)25-15-17-9-5-2-6-10-17;/h3*1-13H,14-15H2,(H,22,23);/q;;;+3/p-3