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(3-methyl-2-propyl-heptyl) 7-methyloctanoate

(3-methyl-2-propyl-heptyl) 7-methyloctanoate

Systemtic Name:(3-methyl-2-propyl-heptyl) 7-methyloctanoate
Openeye Name:(3-methyl-2-propyl-heptyl) 7-methyloctanoate
CAS Name:7-methyloctanoic acid (3-methyl-2-propylheptyl) ester
IUPAC Name:(3-methyl-2-propylheptyl) 7-methyloctanoate
Traditional Name:7-methylcaprylic acid (3-methyl-2-propyl-heptyl) ester
Formula: C20H40O2
MolecularWeight: 312.5304
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(CCC)COC(=O)CCCCCC(C)C


Isomeric SMILES

CCCCC(C)C(CCC)COC(=O)CCCCCC(C)C


InChI

InChI=1S/C20H40O2/c1-6-8-14-18(5)19(12-7-2)16-22-20(21)15-11-9-10-13-17(3)4/h17-19H,6-16H2,1-5H3


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