2-(2,4-dichlorophenyl)ethanoate; titanium(3+)

Systemtic Name: 2-(2,4-dichlorophenyl)ethanoate; titanium(3+) Openeye Name: 2-(2,4-dichlorophenyl)acetate; titanium(3+) CAS Name: 2-(2,4-dichlorophenyl)acetate; titanium(3+) IUPAC Name: 2-(2,4-dichlorophenyl)acetate; titanium(3+) Traditional Name: 2-(2,4-dichlorophenyl)acetate; titanium(3+) Formula: C24H15Cl6O6Ti MolecularWeight: 659.9573

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CC(=O)[O-].C1=CC(=C(C=C1Cl)Cl)CC(=O)[O-].C1=CC(=C(C=C1Cl)Cl)CC(=O)[O-].[Ti+3]

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CC(=O)[O-].C1=CC(=C(C=C1Cl)Cl)CC(=O)[O-].C1=CC(=C(C=C1Cl)Cl)CC(=O)[O-].[Ti+3]

InChI

InChI=1S/3C8H6Cl2O2.Ti/c3*9-6-2-1-5(3-8(11)12)7(10)4-6;/h3*1-2,4H,3H2,(H,11,12);/q;;;+3/p-3