[2-methyl-3-(7-methyloctanoyloxy)-2-(7-methyloctanoyloxymethyl)propyl] 7-methyloctanoate

Systemtic Name: [2-methyl-3-(7-methyloctanoyloxy)-2-(7-methyloctanoyloxymethyl)propyl] 7-methyloctanoate Openeye Name: [2-methyl-3-(7-methyloctanoyloxy)-2-(7-methyloctanoyloxymethyl)propyl] 7-methyloctanoate CAS Name: 7-methyloctanoic acid [2-methyl-3-(7-methyl-1-oxooctoxy)-2-[(7-methyl-1-oxooctoxy)methyl]propyl] ester IUPAC Name: [2-methyl-3-(7-methyloctanoyloxy)-2-(7-methyloctanoyloxymethyl)propyl] 7-methyloctanoate Traditional Name: 7-methylcaprylic acid [2-methyl-3-(7-methyloctanoyloxy)-2-(7-methyloctanoyloxymethyl)propyl] ester Formula: C32H60O6 MolecularWeight: 540.8152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(=O)OCC(C)(COC(=O)CCCCCC(C)C)COC(=O)CCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCC(=O)OCC(C)(COC(=O)CCCCCC(C)C)COC(=O)CCCCCC(C)C

InChI

InChI=1S/C32H60O6/c1-26(2)17-11-8-14-20-29(33)36-23-32(7,24-37-30(34)21-15-9-12-18-27(3)4)25-38-31(35)22-16-10-13-19-28(5)6/h26-28H,8-25H2,1-7H3