[1-[3,5-bis(oxidanyl)phenyl]-8-oxidanylidene-tridecan-2-yl] ethanoate

Systemtic Name: [1-[3,5-bis(oxidanyl)phenyl]-8-oxidanylidene-tridecan-2-yl] ethanoate Openeye Name: [1-[(3,5-dihydroxyphenyl)methyl]-7-oxo-dodecyl] acetate CAS Name: acetic acid [1-(3,5-dihydroxyphenyl)-8-oxotridecan-2-yl] ester IUPAC Name: [1-(3,5-dihydroxyphenyl)-8-oxotridecan-2-yl] acetate Traditional Name: acetic acid [1-(3,5-dihydroxybenzyl)-7-keto-dodecyl] ester Formula: C21H32O5 MolecularWeight: 364.47578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CCCCCC(CC1=CC(=CC(=C1)O)O)OC(=O)C

Isomeric SMILES

CCCCCC(=O)CCCCCC(CC1=CC(=CC(=C1)O)O)OC(=O)C

InChI

InChI=1S/C21H32O5/c1-3-4-6-9-18(23)10-7-5-8-11-21(26-16(2)22)14-17-12-19(24)15-20(25)13-17/h12-13,15,21,24-25H,3-11,14H2,1-2H3