[(1S)-4-dodecoxy-1-(hydroxymethyl)-3-oxidanylidene-2-benzofuran-1-yl]methyl ethanoate

Systemtic Name: [(1S)-4-dodecoxy-1-(hydroxymethyl)-3-oxidanylidene-2-benzofuran-1-yl]methyl ethanoate Openeye Name: [(1S)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-isobenzofuran-1-yl]methyl acetate CAS Name: acetic acid [(1S)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-1-isobenzofuranyl]methyl ester IUPAC Name: [(1S)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-2-benzofuran-1-yl]methyl acetate Traditional Name: acetic acid [(1S)-3-keto-4-lauryloxy-1-methylol-phthalan-1-yl]methyl ester Formula: C24H36O6 MolecularWeight: 420.53904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC2=C1C(=O)OC2(CO)COC(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC2=C1C(=O)O[C@@]2(CO)COC(=O)C

InChI

InChI=1S/C24H36O6/c1-3-4-5-6-7-8-9-10-11-12-16-28-21-15-13-14-20-22(21)23(27)30-24(20,17-25)18-29-19(2)26/h13-15,25H,3-12,16-18H2,1-2H3/t24-/m0/s1