carbanide; cyclopentane; titanium(3+); hydrate

Systemtic Name: carbanide; cyclopentane; titanium(3+); hydrate Openeye Name: carbanide; cyclopentane; titanium(3+); hydrate CAS Name: carbanide; cyclopentane; titanium(3+); hydrate IUPAC Name: carbanide; cyclopentane; titanium(3+); hydrate Traditional Name: carbanide; cyclopentane; titanium(3+); hydrate Formula: C22H28OTi2+4 MolecularWeight: 404.19112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.O.[Ti+3].[Ti+3]

Isomeric SMILES

[CH3-].[CH3-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.O.[Ti+3].[Ti+3]

InChI

InChI=1S/4C5H5.2CH3.H2O.2Ti/c4*1-2-4-5-3-1;;;;;/h4*1-5H;2*1H3;1H2;;/q;;;;2*-1;;2*+3