decanedioate; docosanoate

Systemtic Name: decanedioate; docosanoate Openeye Name: decanedioate; docosanoate CAS Name: decanedioate; docosanoate IUPAC Name: decanedioate; docosanoate Traditional Name: behenate; sebacate Formula: C32H59O6-3 MolecularWeight: 539.80726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].C(CCCCC(=O)[O-])CCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].C(CCCCC(=O)[O-])CCCC(=O)[O-]

InChI

InChI=1S/C22H44O2.C10H18O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24;11-9(12)7-5-3-1-2-4-6-8-10(13)14/h2-21H2,1H3,(H,23,24);1-8H2,(H,11,12)(H,13,14)/p-3