butane; (Z)-4-oxidanylidenepent-2-en-2-olate; titanium(2+)

Systemtic Name: butane; (Z)-4-oxidanylidenepent-2-en-2-olate; titanium(2+) Openeye Name: butane; (Z)-4-oxopent-2-en-2-olate; titanium(2+) CAS Name: butane; (Z)-4-oxo-2-penten-2-olate; titanium(2+) IUPAC Name: butane; (Z)-4-oxopent-2-en-2-olate; titanium(2+) Traditional Name: butane; (Z)-4-ketopent-2-en-2-olate; titanium(2+) Formula: C13H25O2Ti- MolecularWeight: 261.2034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[CH2-].CCC[CH2-].C/C(=C/C(=O)C)/[O-].[Ti+2]

InChI

InChI=1S/C5H8O2.2C4H9.Ti/c1-4(6)3-5(2)7;2*1-3-4-2;/h3,6H,1-2H3;2*1,3-4H2,2H3;/q;2*-1;+2/p-1/b4-3-;;;