(6-chloranyl-10-octanoyloxy-3,4-dihydrobenzo[g][1,2]benzodioxin-5-yl) octanoate

Systemtic Name: (6-chloranyl-10-octanoyloxy-3,4-dihydrobenzo[g][1,2]benzodioxin-5-yl) octanoate Openeye Name: (6-chloro-10-octanoyloxy-3,4-dihydrobenzo[g][1,2]benzodioxin-5-yl) octanoate CAS Name: octanoic acid [6-chloro-10-(1-oxooctoxy)-3,4-dihydrobenzo[g][1,2]benzodioxin-5-yl] ester IUPAC Name: (6-chloro-10-octanoyloxy-3,4-dihydrobenzo[g][1,2]benzodioxin-5-yl) octanoate Traditional Name: caprylic acid (10-caprylyloxy-6-chloro-3,4-dihydrobenzo[g][1,2]benzodioxin-5-yl) ester Formula: C28H37ClO6 MolecularWeight: 505.04278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=C2CCOOC2=C(C3=C1C(=CC=C3)Cl)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)OC1=C2CCOOC2=C(C3=C1C(=CC=C3)Cl)OC(=O)CCCCCCC

InChI

InChI=1S/C28H37ClO6/c1-3-5-7-9-11-16-23(30)33-26-21-18-19-32-35-28(21)27(20-14-13-15-22(29)25(20)26)34-24(31)17-12-10-8-6-4-2/h13-15H,3-12,16-19H2,1-2H3