2-[2-(8-acetyloxy-4-ethanoyl-tridecyl)phenyl]ethanoate

Systemtic Name: 2-[2-(8-acetyloxy-4-ethanoyl-tridecyl)phenyl]ethanoate Openeye Name: 2-[2-(8-acetoxy-4-acetyl-tridecyl)phenyl]acetate CAS Name: 2-[2-(4-acetyl-8-acetyloxytridecyl)phenyl]acetate IUPAC Name: 2-[2-(4-acetyl-8-acetyloxytridecyl)phenyl]acetate Traditional Name: 2-[2-(8-acetoxy-4-acetyl-tridecyl)phenyl]acetate Formula: C25H37O5- MolecularWeight: 417.55828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCC1=CC=CC=C1CC(=O)[O-])C(=O)C)OC(=O)C

Isomeric SMILES

CCCCCC(CCCC(CCCC1=CC=CC=C1CC(=O)[O-])C(=O)C)OC(=O)C

InChI

InChI=1S/C25H38O5/c1-4-5-6-16-24(30-20(3)27)17-10-14-21(19(2)26)13-9-15-22-11-7-8-12-23(22)18-25(28)29/h7-8,11-12,21,24H,4-6,9-10,13-18H2,1-3H3,(H,28,29)/p-1