12-butanoyloxy-8-ethanoyl-heptadecanoic acid

Systemtic Name: 12-butanoyloxy-8-ethanoyl-heptadecanoic acid Openeye Name: 8-acetyl-12-butanoyloxy-heptadecanoic acid CAS Name: 8-acetyl-12-(1-oxobutoxy)heptadecanoic acid IUPAC Name: 8-acetyl-12-butanoyloxyheptadecanoic acid Traditional Name: 8-acetyl-12-butyryloxy-heptadecanoic acid Formula: C23H42O5 MolecularWeight: 398.57658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)O)C(=O)C)OC(=O)CCC

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)O)C(=O)C)OC(=O)CCC

InChI

InChI=1S/C23H42O5/c1-4-6-9-16-21(28-23(27)13-5-2)17-12-15-20(19(3)24)14-10-7-8-11-18-22(25)26/h20-21H,4-18H2,1-3H3,(H,25,26)