[2-oxidanyl-2-(5-oxidanyl-3-oxidanylidene-4-pentadecoxy-furan-2-yl)ethyl] benzoate

Systemtic Name: [2-oxidanyl-2-(5-oxidanyl-3-oxidanylidene-4-pentadecoxy-furan-2-yl)ethyl] benzoate Openeye Name: [2-hydroxy-2-(5-hydroxy-3-oxo-4-pentadecoxy-2-furyl)ethyl] benzoate CAS Name: benzoic acid [2-hydroxy-2-(5-hydroxy-3-oxo-4-pentadecoxy-2-furanyl)ethyl] ester IUPAC Name: [2-hydroxy-2-(5-hydroxy-3-oxo-4-pentadecoxyfuran-2-yl)ethyl] benzoate Traditional Name: benzoic acid [2-hydroxy-2-(5-hydroxy-3-keto-4-pentadecoxy-2-furyl)ethyl] ester Formula: C28H42O7 MolecularWeight: 490.62888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=C(OC(C1=O)C(COC(=O)C2=CC=CC=C2)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=C(OC(C1=O)C(COC(=O)C2=CC=CC=C2)O)O

InChI

InChI=1S/C28H42O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-33-26-24(30)25(35-28(26)32)23(29)21-34-27(31)22-18-15-14-16-19-22/h14-16,18-19,23,25,29,32H,2-13,17,20-21H2,1H3