ethanoic acid; ethyl 2-heptylnonanoate

Systemtic Name: ethanoic acid; ethyl 2-heptylnonanoate Openeye Name: acetic acid; ethyl 2-heptylnonanoate CAS Name: acetic acid; 2-heptylnonanoic acid ethyl ester IUPAC Name: acetic acid; ethyl 2-heptylnonanoate Traditional Name: acetic acid; 2-heptylpelargonic acid ethyl ester Formula: C32H64O16 MolecularWeight: 704.84096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCCCC)C(=O)OCC.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

Isomeric SMILES

CCCCCCCC(CCCCCCC)C(=O)OCC.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

InChI

InChI=1S/C18H36O2.7C2H4O2/c1-4-7-9-11-13-15-17(18(19)20-6-3)16-14-12-10-8-5-2;7*1-2(3)4/h17H,4-16H2,1-3H3;7*1H3,(H,3,4)