2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate; ethanolate; titanium

Systemtic Name: 2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate; ethanolate; titanium Openeye Name: 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate; ethanolate; titanium CAS Name: 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate; ethanolate; titanium IUPAC Name: 2,2-dimethyl-6-oxo-1,3-dioxin-4-olate; ethanolate; titanium Traditional Name: ethanolate; 6-keto-2,2-dimethyl-1,3-dioxin-4-olate; titanium Formula: C16H24O10Ti-4 MolecularWeight: 424.22276

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].CC1(OC(=CC(=O)O1)[O-])C.CC1(OC(=CC(=O)O1)[O-])C.[Ti]

Isomeric SMILES

CC[O-].CC[O-].CC1(OC(=CC(=O)O1)[O-])C.CC1(OC(=CC(=O)O1)[O-])C.[Ti]

InChI

InChI=1S/2C6H8O4.2C2H5O.Ti/c2*1-6(2)9-4(7)3-5(8)10-6;2*1-2-3;/h2*3,7H,1-2H3;2*2H2,1H3;/q;;2*-1;/p-2