ethane; titanium(2+); tetrabenzoate; tetrachloride

Systemtic Name: ethane; titanium(2+); tetrabenzoate; tetrachloride Openeye Name: ethane; titanium(2+); tetrabenzoate; tetrachloride CAS Name: ethane; titanium(2+); tetrabenzoate; tetrachloride IUPAC Name: ethane; titanium(2+); tetrabenzoate; tetrachloride Traditional Name: ethane; titanium(2+); tetrabenzoate; tetrachloride Formula: C30H25Cl4O8Ti-7 MolecularWeight: 703.1937

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Descriptors Computed from Structure

Canonical SMILES:

C[CH2-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

C[CH2-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/4C7H6O2.C2H5.4ClH.Ti/c4*8-7(9)6-4-2-1-3-5-6;1-2;;;;;/h4*1-5H,(H,8,9);1H2,2H3;4*1H;/q;;;;-1;;;;;+2/p-8