(2-octanoyloxy-3-oxidanyl-propyl) octanoate; pentanedioic acid

Systemtic Name: (2-octanoyloxy-3-oxidanyl-propyl) octanoate; pentanedioic acid Openeye Name: glutaric acid; (3-hydroxy-2-octanoyloxy-propyl) octanoate CAS Name: octanoic acid [3-hydroxy-2-(1-oxooctoxy)propyl] ester; pentanedioic acid IUPAC Name: (3-hydroxy-2-octanoyloxypropyl) octanoate; pentanedioic acid Traditional Name: caprylic acid (2-caprylyloxy-3-hydroxy-propyl) ester; glutaric acid Formula: C24H44O9 MolecularWeight: 476.60076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC.C(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC.C(CC(=O)O)CC(=O)O

InChI

InChI=1S/C19H36O5.C5H8O4/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2;6-4(7)2-1-3-5(8)9/h17,20H,3-16H2,1-2H3;1-3H2,(H,6,7)(H,8,9)