5-octadecoxybenzene-1,3-dicarboxylate

Systemtic Name: 5-octadecoxybenzene-1,3-dicarboxylate Openeye Name: 5-octadecoxybenzene-1,3-dicarboxylate CAS Name: 5-octadecoxybenzene-1,3-dicarboxylate IUPAC Name: 5-octadecoxybenzene-1,3-dicarboxylate Traditional Name: 5-stearyloxyisophthalate Formula: C26H40O5-2 MolecularWeight: 432.5928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C26H42O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31-24-20-22(25(27)28)19-23(21-24)26(29)30/h19-21H,2-18H2,1H3,(H,27,28)(H,29,30)/p-2