zinc 5-methoxy-2-(3-oxidanylidene-3-phenyl-propanoyl)benzoate

Systemtic Name: zinc 5-methoxy-2-(3-oxidanylidene-3-phenyl-propanoyl)benzoate Openeye Name: zinc 5-methoxy-2-(3-oxo-3-phenyl-propanoyl)benzoate CAS Name: zinc 2-(1,3-dioxo-3-phenylpropyl)-5-methoxybenzoate IUPAC Name: zinc 5-methoxy-2-(3-oxo-3-phenylpropanoyl)benzoate Traditional Name: zinc 2-(3-keto-3-phenyl-propanoyl)-5-methoxy-benzoate Formula: C34H26O10Zn MolecularWeight: 659.97324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2)C(=O)[O-].COC1=CC(=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2)C(=O)[O-].[Zn+2]

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2)C(=O)[O-].COC1=CC(=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2)C(=O)[O-].[Zn+2]

InChI

InChI=1S/2C17H14O5.Zn/c2*1-22-12-7-8-13(14(9-12)17(20)21)16(19)10-15(18)11-5-3-2-4-6-11;/h2*2-9H,10H2,1H3,(H,20,21);/q;;+2/p-2