carbanide; cyclopenta-1,3-diene; ethanolate; titanium(4+)

Systemtic Name: carbanide; cyclopenta-1,3-diene; ethanolate; titanium(4+) Openeye Name: carbanide; cyclopenta-1,3-diene; ethanolate; titanium(4+) CAS Name: carbanide; cyclopenta-1,3-diene; ethanolate; titanium(4+) IUPAC Name: carbanide; cyclopenta-1,3-diene; ethanolate; titanium(4+) Traditional Name: carbanide; cyclopenta-1,3-diene; ethanolate; titanium(4+) Formula: C13H18OTi MolecularWeight: 238.14842

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].CC[O-].C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

[CH3-].CC[O-].C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

InChI

InChI=1S/2C5H5.C2H5O.CH3.Ti/c2*1-2-4-5-3-1;1-2-3;;/h2*1-3H,4H2;2H2,1H3;1H3;/q4*-1;+4