pentane; pentane; titanium; hydrate

Systemtic Name: pentane; pentane; titanium; hydrate Openeye Name: pentane; pentane; titanium; hydrate CAS Name: pentane; pentane; titanium; hydrate IUPAC Name: pentane; pentane; titanium; hydrate Traditional Name: n-pentane; pentane; titanium; hydrate Formula: C30H69OTi2-5 MolecularWeight: 541.60226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC.CCCC[CH2-].CCCC[CH2-].CCCC[CH2-].CCCC[CH2-].CCCC[CH2-].O.[Ti].[Ti]

Isomeric SMILES

CCCCC.CCCC[CH2-].CCCC[CH2-].CCCC[CH2-].CCCC[CH2-].CCCC[CH2-].O.[Ti].[Ti]

InChI

InChI=1S/C5H12.5C5H11.H2O.2Ti/c6*1-3-5-4-2;;;/h3-5H2,1-2H3;5*1,3-5H2,2H3;1H2;;/q;5*-1;;;