aluminum 2-propan-2-yloxy-2-(2-propan-2-yloxyethanoyl)pentanoate

Systemtic Name: aluminum 2-propan-2-yloxy-2-(2-propan-2-yloxyethanoyl)pentanoate Openeye Name: aluminum 2-isopropoxy-2-(2-isopropoxyacetyl)pentanoate CAS Name: aluminum 2-(1-oxo-2-propan-2-yloxyethyl)-2-propan-2-yloxypentanoate IUPAC Name: aluminum 2-propan-2-yloxy-2-(2-propan-2-yloxyacetyl)pentanoate Traditional Name: aluminum 2-isopropoxy-2-(2-isopropoxyacetyl)valerate Formula: C39H69AlO15 MolecularWeight: 804.937698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)COC(C)C)(C(=O)[O-])OC(C)C.CCCC(C(=O)COC(C)C)(C(=O)[O-])OC(C)C.CCCC(C(=O)COC(C)C)(C(=O)[O-])OC(C)C.[Al+3]

Isomeric SMILES

CCCC(C(=O)COC(C)C)(C(=O)[O-])OC(C)C.CCCC(C(=O)COC(C)C)(C(=O)[O-])OC(C)C.CCCC(C(=O)COC(C)C)(C(=O)[O-])OC(C)C.[Al+3]

InChI

InChI=1S/3C13H24O5.Al/c3*1-6-7-13(12(15)16,18-10(4)5)11(14)8-17-9(2)3;/h3*9-10H,6-8H2,1-5H3,(H,15,16);/q;;;+3/p-3