calcium 6-octadecoxy-6-oxidanylidene-hexanoate

Systemtic Name: calcium 6-octadecoxy-6-oxidanylidene-hexanoate Openeye Name: calcium 6-octadecoxy-6-oxo-hexanoate CAS Name: calcium 6-octadecoxy-6-oxohexanoate IUPAC Name: calcium 6-octadecoxy-6-oxohexanoate Traditional Name: calcium 6-keto-6-stearyloxy-hexanoate Formula: C48H90CaO8 MolecularWeight: 835.3014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)[O-].[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)[O-].[Ca+2]

InChI

InChI=1S/2C24H46O4.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-28-24(27)21-18-17-20-23(25)26;/h2*2-22H2,1H3,(H,25,26);/q;;+2/p-2