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: C26H50O4Ti2-2 MolecularWeight: 522.4068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C5H8O2.4C4H9.2Ti/c2*1-4(6)3-5(2)7;4*1-3-4-2;;/h2*3,6H,1-2H3;4*1,3-4H2,2H3;;/q;;4*-1;2*+2/p-2/b2*4-3-;;;;;;