ethane; 2-methylpropane; propane; titanium; titanium(2+); hydrate

Systemtic Name: ethane; 2-methylpropane; propane; titanium; titanium(2+); hydrate Openeye Name: ethane; 2-methylpropane; propane; titanium; titanium(2+); hydrate CAS Name: ethane; 2-methylpropane; propane; titanium; titanium(2+); hydrate IUPAC Name: ethane; 2-methylpropane; propane; titanium; titanium(2+); hydrate Traditional Name: ethane; 2-methylpropane; propane; titanium; titanium(2+); hydrate Formula: C18H44OTi2-4 MolecularWeight: 372.27536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C4H9.2C3H7.2C2H5.H2O.2Ti/c2*1-4(2)3;2*1-3-2;2*1-2;;;/h2*1-3H3;2*1,3H2,2H3;2*1H2,2H3;1H2;;/q6*-1;;;+2