[(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxidanylidene-2-benzofuran-1-yl]methyl dodecanoate

Systemtic Name: [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxidanylidene-2-benzofuran-1-yl]methyl dodecanoate Openeye Name: [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-isobenzofuran-1-yl]methyl dodecanoate CAS Name: dodecanoic acid [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-1-isobenzofuranyl]methyl ester IUPAC Name: [(1R)-4-dodecoxy-1-(hydroxymethyl)-3-oxo-2-benzofuran-1-yl]methyl dodecanoate Traditional Name: lauric acid [(1R)-3-keto-4-lauryloxy-1-methylol-phthalan-1-yl]methyl ester Formula: C34H56O6 MolecularWeight: 560.80484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H56O6/c1-3-5-7-9-11-13-15-17-19-21-26-38-30-24-22-23-29-32(30)33(37)40-34(29,27-35)28-39-31(36)25-20-18-16-14-12-10-8-6-4-2/h22-24,35H,3-21,25-28H2,1-2H3/t34-/m1/s1