(5-methyl-2-propyl-heptyl) 8-methylnonanoate

Systemtic Name: (5-methyl-2-propyl-heptyl) 8-methylnonanoate Openeye Name: (5-methyl-2-propyl-heptyl) 8-methylnonanoate CAS Name: 8-methylnonanoic acid (5-methyl-2-propylheptyl) ester IUPAC Name: (5-methyl-2-propylheptyl) 8-methylnonanoate Traditional Name: 8-methylpelargonic acid (5-methyl-2-propyl-heptyl) ester Formula: C21H42O2 MolecularWeight: 326.55698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(C)CC)COC(=O)CCCCCCC(C)C

Isomeric SMILES

CCCC(CCC(C)CC)COC(=O)CCCCCCC(C)C

InChI

InChI=1S/C21H42O2/c1-6-12-20(16-15-19(5)7-2)17-23-21(22)14-11-9-8-10-13-18(3)4/h18-20H,6-17H2,1-5H3