butan-1-ol; oxecane-2-carboxylate; titanium(2+)

Systemtic Name: butan-1-ol; oxecane-2-carboxylate; titanium(2+) Openeye Name: butan-1-ol; oxecane-2-carboxylate; titanium(2+) CAS Name: 1-butanol; 2-oxecanecarboxylate; titanium(2+) IUPAC Name: butan-1-ol; oxecane-2-carboxylate; titanium(2+) Traditional Name: butan-1-ol; oxecane-2-carboxylate; titanium(2+) Formula: C28H54O8Ti MolecularWeight: 566.59056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.C1CCCCOC(CCC1)C(=O)[O-].C1CCCCOC(CCC1)C(=O)[O-].[Ti+2]

Isomeric SMILES

CCCCO.CCCCO.C1CCCCOC(CCC1)C(=O)[O-].C1CCCCOC(CCC1)C(=O)[O-].[Ti+2]

InChI

InChI=1S/2C10H18O3.2C4H10O.Ti/c2*11-10(12)9-7-5-3-1-2-4-6-8-13-9;2*1-2-3-4-5;/h2*9H,1-8H2,(H,11,12);2*5H,2-4H2,1H3;/q;;;;+2/p-2