heptan-3-yl octanoate

Systemtic Name: heptan-3-yl octanoate Openeye Name: 1-ethylpentyl octanoate CAS Name: octanoic acid heptan-3-yl ester IUPAC Name: heptan-3-yl octanoate Traditional Name: caprylic acid 1-ethylpentyl ester Formula: C15H30O2 MolecularWeight: 242.3975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(CC)CCCC

Isomeric SMILES

CCCCCCCC(=O)OC(CC)CCCC

InChI

InChI=1S/C15H30O2/c1-4-7-9-10-11-13-15(16)17-14(6-3)12-8-5-2/h14H,4-13H2,1-3H3