methyl 2-octadecoxy-3,6-bis(oxidanyl)benzoate

Systemtic Name: methyl 2-octadecoxy-3,6-bis(oxidanyl)benzoate Openeye Name: methyl 3,6-dihydroxy-2-octadecoxy-benzoate CAS Name: 3,6-dihydroxy-2-octadecoxybenzoic acid methyl ester IUPAC Name: methyl 3,6-dihydroxy-2-octadecoxybenzoate Traditional Name: 3,6-dihydroxy-2-stearyloxy-benzoic acid methyl ester Formula: C26H44O5 MolecularWeight: 436.62456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C=CC(=C1C(=O)OC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C=CC(=C1C(=O)OC)O)O

InChI

InChI=1S/C26H44O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31-25-23(28)20-19-22(27)24(25)26(29)30-2/h19-20,27-28H,3-18,21H2,1-2H3