2,3,5,6-tetramethylbenzoate; thallium(1+)

Systemtic Name: 2,3,5,6-tetramethylbenzoate; thallium(1+) Openeye Name: 2,3,5,6-tetramethylbenzoate; thallium(1+) CAS Name: 2,3,5,6-tetramethylbenzoate; thallium(1+) IUPAC Name: 2,3,5,6-tetramethylbenzoate; thallium(1+) Traditional Name: 2,3,5,6-tetramethylbenzoate; thallium(1+) Formula: C11H13O2Tl MolecularWeight: 381.60302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)[O-])C)C.[Tl+]

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)[O-])C)C.[Tl+]

InChI

InChI=1S/C11H14O2.Tl/c1-6-5-7(2)9(4)10(8(6)3)11(12)13;/h5H,1-4H3,(H,12,13);/q;+1/p-1