butan-1-ol; 10-oxabicyclo[9.7.0]octadecane-11-carboxylate; titanium(2+)

Systemtic Name: butan-1-ol; 10-oxabicyclo[9.7.0]octadecane-11-carboxylate; titanium(2+) Openeye Name: butan-1-ol; 10-oxabicyclo[9.7.0]octadecane-11-carboxylate; titanium(2+) CAS Name: 1-butanol; 10-oxabicyclo[9.7.0]octadecane-11-carboxylate; titanium(2+) IUPAC Name: butan-1-ol; 10-oxabicyclo[9.7.0]octadecane-11-carboxylate; titanium(2+) Traditional Name: butan-1-ol; 10-oxabicyclo[9.7.0]octadecane-11-carboxylate; titanium(2+) Formula: C44H82O8Ti MolecularWeight: 786.98408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.C1CCCCOC2(CCCCCCCC2CCC1)C(=O)[O-].C1CCCCOC2(CCCCCCCC2CCC1)C(=O)[O-].[Ti+2]

Isomeric SMILES

CCCCO.CCCCO.C1CCCCOC2(CCCCCCCC2CCC1)C(=O)[O-].C1CCCCOC2(CCCCCCCC2CCC1)C(=O)[O-].[Ti+2]

InChI

InChI=1S/2C18H32O3.2C4H10O.Ti/c2*19-17(20)18-14-10-6-3-5-9-13-16(18)12-8-4-1-2-7-11-15-21-18;2*1-2-3-4-5;/h2*16H,1-15H2,(H,19,20);2*5H,2-4H2,1H3;/q;;;;+2/p-2