methyl 8-chloranyl-8-ethanoyl-12-oxidanyl-heptadecanoate

Systemtic Name: methyl 8-chloranyl-8-ethanoyl-12-oxidanyl-heptadecanoate Openeye Name: methyl 8-acetyl-8-chloro-12-hydroxy-heptadecanoate CAS Name: 8-acetyl-8-chloro-12-hydroxyheptadecanoic acid methyl ester IUPAC Name: methyl 8-acetyl-8-chloro-12-hydroxyheptadecanoate Traditional Name: 8-acetyl-8-chloro-12-hydroxy-heptadecanoic acid methyl ester Formula: C20H37ClO4 MolecularWeight: 376.95838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H37ClO4/c1-4-5-8-12-18(23)13-11-16-20(21,17(2)22)15-10-7-6-9-14-19(24)25-3/h18,23H,4-16H2,1-3H3