benzene; butane; titanium; titanium(2+); hydrate

Systemtic Name: benzene; butane; titanium; titanium(2+); hydrate Openeye Name: benzene; butane; titanium; titanium(2+); hydrate CAS Name: benzene; butane; titanium; titanium(2+); hydrate IUPAC Name: benzene; butane; titanium; titanium(2+); hydrate Traditional Name: benzene; butane; titanium; titanium(2+); hydrate Formula: C28H48OTi2-4 MolecularWeight: 496.41412

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Descriptors Computed from Structure

Canonical SMILES:

CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.O.[Ti].[Ti+2]

Isomeric SMILES

CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.O.[Ti].[Ti+2]

InChI

InChI=1S/2C6H5.4C4H9.H2O.2Ti/c2*1-2-4-6-5-3-1;4*1-3-4-2;;;/h2*1-5H;4*1,3-4H2,2H3;1H2;;/q6*-1;;;+2