[3-acetamido-3-(acetyloxymethyl)-5-(4-octylphenyl)pentyl] ethanoate

Systemtic Name: [3-acetamido-3-(acetyloxymethyl)-5-(4-octylphenyl)pentyl] ethanoate Openeye Name: [3-acetamido-3-(acetoxymethyl)-5-(4-octylphenyl)pentyl] acetate CAS Name: acetic acid [3-acetamido-3-(acetyloxymethyl)-5-(4-octylphenyl)pentyl] ester IUPAC Name: [3-acetamido-3-(acetyloxymethyl)-5-(4-octylphenyl)pentyl] acetate Traditional Name: acetic acid [3-acetamido-3-(acetoxymethyl)-5-(4-octylphenyl)pentyl] ester Formula: C26H41NO5 MolecularWeight: 447.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CCOC(=O)C)(COC(=O)C)NC(=O)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CCOC(=O)C)(COC(=O)C)NC(=O)C

InChI

InChI=1S/C26H41NO5/c1-5-6-7-8-9-10-11-24-12-14-25(15-13-24)16-17-26(27-21(2)28,20-32-23(4)30)18-19-31-22(3)29/h12-15H,5-11,16-20H2,1-4H3,(H,27,28)