[2-ethyl-4,5-bis(oxidanyl)oxolan-3-yl] 5-octanoyl-2-oxidanyl-benzoate

Systemtic Name: [2-ethyl-4,5-bis(oxidanyl)oxolan-3-yl] 5-octanoyl-2-oxidanyl-benzoate Openeye Name: (2-ethyl-4,5-dihydroxy-tetrahydrofuran-3-yl) 2-hydroxy-5-octanoyl-benzoate CAS Name: 2-hydroxy-5-(1-oxooctyl)benzoic acid (2-ethyl-4,5-dihydroxy-3-oxolanyl) ester IUPAC Name: (2-ethyl-4,5-dihydroxyoxolan-3-yl) 2-hydroxy-5-octanoylbenzoate Traditional Name: 5-caprylyl-2-hydroxy-benzoic acid (2-ethyl-4,5-dihydroxy-tetrahydrofuran-3-yl) ester Formula: C21H30O7 MolecularWeight: 394.4587

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)OC2C(OC(C2O)O)CC

Isomeric SMILES

CCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)OC2C(OC(C2O)O)CC

InChI

InChI=1S/C21H30O7/c1-3-5-6-7-8-9-15(22)13-10-11-16(23)14(12-13)20(25)28-19-17(4-2)27-21(26)18(19)24/h10-12,17-19,21,23-24,26H,3-9H2,1-2H3