[2-methyl-2-(6-methylheptanoyloxymethyl)butyl] octanoate

Systemtic Name: [2-methyl-2-(6-methylheptanoyloxymethyl)butyl] octanoate Openeye Name: [2-methyl-2-(6-methylheptanoyloxymethyl)butyl] octanoate CAS Name: octanoic acid [2-methyl-2-[(6-methyl-1-oxoheptoxy)methyl]butyl] ester IUPAC Name: [2-methyl-2-(6-methylheptanoyloxymethyl)butyl] octanoate Traditional Name: caprylic acid [2-methyl-2-(6-methylheptanoyloxymethyl)butyl] ester Formula: C22H42O4 MolecularWeight: 370.56648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(C)(CC)COC(=O)CCCCC(C)C

Isomeric SMILES

CCCCCCCC(=O)OCC(C)(CC)COC(=O)CCCCC(C)C

InChI

InChI=1S/C22H42O4/c1-6-8-9-10-11-15-20(23)25-17-22(5,7-2)18-26-21(24)16-13-12-14-19(3)4/h19H,6-18H2,1-5H3