bis(oxidanidyl)-oxidanylidene-titanium; ethanone; propane; titanium(4+)

Systemtic Name: bis(oxidanidyl)-oxidanylidene-titanium; ethanone; propane; titanium(4+) Openeye Name: dioxido(oxo)titanium; ethanone; propane; titanium(4+) CAS Name: dioxido(oxo)titanium; ethanone; propane; titanium(4+) IUPAC Name: dioxido(oxo)titanium; ethanone; propane; titanium(4+) Traditional Name: ethanone; keto(dioxido)titanium; n-propane; titanium(4+) Formula: C24H50O12Ti3-6 MolecularWeight: 674.2476

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CCC.CCC.CCC.C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[Ti+4]

Isomeric SMILES

CCC.CCC.CCC.CCC.C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[Ti+4]

InChI

InChI=1S/4C3H8.6C2H3O.6O.3Ti/c4*1-3-2;6*1-2-3;;;;;;;;;/h4*3H2,1-2H3;6*1H3;;;;;;;;;/q;;;;6*-1;;;4*-1;;;+4