2-ethylhexan-1-olate; (Z)-4-oxidanylidenepent-2-en-2-olate; titanium(4+)

Systemtic Name: 2-ethylhexan-1-olate; (Z)-4-oxidanylidenepent-2-en-2-olate; titanium(4+) Openeye Name: 2-ethylhexan-1-olate; (Z)-4-oxopent-2-en-2-olate; titanium(4+) CAS Name: 2-ethyl-1-hexanolate; (Z)-4-oxo-2-penten-2-olate; titanium(4+) IUPAC Name: 2-ethylhexan-1-olate; (Z)-4-oxopent-2-en-2-olate; titanium(4+) Traditional Name: 2-ethylhexan-1-olate; (Z)-4-ketopent-2-en-2-olate; titanium(4+) Formula: C26H48O6Ti MolecularWeight: 504.52272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[O-].CCCCC(CC)C[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Ti+4]

Isomeric SMILES

CCCCC(C[O-])CC.CCCCC(C[O-])CC.C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Ti+4]

InChI

InChI=1S/2C8H17O.2C5H8O2.Ti/c2*1-3-5-6-8(4-2)7-9;2*1-4(6)3-5(2)7;/h2*8H,3-7H2,1-2H3;2*3,6H,1-2H3;/q2*-1;;;+4/p-2/b;;2*4-3-;