7,7-dimethyloctanoate; ethanolate; niobium(5+)

Systemtic Name: 7,7-dimethyloctanoate; ethanolate; niobium(5+) Openeye Name: 7,7-dimethyloctanoate; ethanolate; niobium(5+) CAS Name: 7,7-dimethyloctanoate; ethanolate; niobium(5+) IUPAC Name: 7,7-dimethyloctanoate; ethanolate; niobium(5+) Traditional Name: 7,7-dimethylcaprylate; ethanolate; niobium(5+) Formula: C34H67NbO8 MolecularWeight: 696.79736

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Nb+5]

Isomeric SMILES

CC[O-].CC[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Nb+5]

InChI

InChI=1S/3C10H20O2.2C2H5O.Nb/c3*1-10(2,3)8-6-4-5-7-9(11)12;2*1-2-3;/h3*4-8H2,1-3H3,(H,11,12);2*2H2,1H3;/q;;;2*-1;+5/p-3