12-acetyloxy-8-chloranyl-8-ethanoyl-heptadecanoic acid

Systemtic Name: 12-acetyloxy-8-chloranyl-8-ethanoyl-heptadecanoic acid Openeye Name: 12-acetoxy-8-acetyl-8-chloro-heptadecanoic acid CAS Name: 8-acetyl-12-acetyloxy-8-chloroheptadecanoic acid IUPAC Name: 8-acetyl-12-acetyloxy-8-chloroheptadecanoic acid Traditional Name: 12-acetoxy-8-acetyl-8-chloro-heptadecanoic acid Formula: C21H37ClO5 MolecularWeight: 404.96848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H37ClO5/c1-4-5-8-12-19(27-18(3)24)13-11-16-21(22,17(2)23)15-10-7-6-9-14-20(25)26/h19H,4-16H2,1-3H3,(H,25,26)