ethyl 12-acetyloxy-8-ethanoyl-13,13-dimethyl-heptadecanoate

Systemtic Name: ethyl 12-acetyloxy-8-ethanoyl-13,13-dimethyl-heptadecanoate Openeye Name: ethyl 12-acetoxy-8-acetyl-13,13-dimethyl-heptadecanoate CAS Name: 8-acetyl-12-acetyloxy-13,13-dimethylheptadecanoic acid ethyl ester IUPAC Name: ethyl 8-acetyl-12-acetyloxy-13,13-dimethylheptadecanoate Traditional Name: 12-acetoxy-8-acetyl-13,13-dimethyl-heptadecanoic acid ethyl ester Formula: C25H46O5 MolecularWeight: 426.62974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CCCC(CCCCCCC(=O)OCC)C(=O)C)OC(=O)C

Isomeric SMILES

CCCCC(C)(C)C(CCCC(CCCCCCC(=O)OCC)C(=O)C)OC(=O)C

InChI

InChI=1S/C25H46O5/c1-7-9-19-25(5,6)23(30-21(4)27)17-14-16-22(20(3)26)15-12-10-11-13-18-24(28)29-8-2/h22-23H,7-19H2,1-6H3