1-[1,3-bis(oxidanylidene)inden-2-ylidene]-2,2-dimethyl-propan-1-olate; ethanolate; titanium

Systemtic Name: 1-[1,3-bis(oxidanylidene)inden-2-ylidene]-2,2-dimethyl-propan-1-olate; ethanolate; titanium Openeye Name: 1-(1,3-dioxoindan-2-ylidene)-2,2-dimethyl-propan-1-olate; ethanolate; titanium CAS Name: 1-(1,3-dioxo-2-indenylidene)-2,2-dimethyl-1-propanolate; ethanolate; titanium IUPAC Name: 1-(1,3-dioxoinden-2-ylidene)-2,2-dimethylpropan-1-olate; ethanolate; titanium Traditional Name: 1-(1,3-diketoindan-2-ylidene)-2,2-dimethyl-propan-1-olate; ethanolate; titanium Formula: C32H36O8Ti-4 MolecularWeight: 596.49044

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].CC(C)(C)C(=C1C(=O)C2=CC=CC=C2C1=O)[O-].CC(C)(C)C(=C1C(=O)C2=CC=CC=C2C1=O)[O-].[Ti]

Isomeric SMILES

CC[O-].CC[O-].CC(C)(C)C(=C1C(=O)C2=CC=CC=C2C1=O)[O-].CC(C)(C)C(=C1C(=O)C2=CC=CC=C2C1=O)[O-].[Ti]

InChI

InChI=1S/2C14H14O3.2C2H5O.Ti/c2*1-14(2,3)13(17)10-11(15)8-6-4-5-7-9(8)12(10)16;2*1-2-3;/h2*4-7,17H,1-3H3;2*2H2,1H3;/q;;2*-1;/p-2