[2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)butyl] ethanoate

Systemtic Name: [2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)butyl] ethanoate Openeye Name: [2-acetamido-2-(acetoxymethyl)-4-(4-octylphenyl)butyl] acetate CAS Name: acetic acid [2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)butyl] ester IUPAC Name: [2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)butyl] acetate Traditional Name: acetic acid [2-acetamido-2-(acetoxymethyl)-4-(4-octylphenyl)butyl] ester Formula: C25H39NO5 MolecularWeight: 433.58086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39NO5/c1-5-6-7-8-9-10-11-23-12-14-24(15-13-23)16-17-25(26-20(2)27,18-30-21(3)28)19-31-22(4)29/h12-15H,5-11,16-19H2,1-4H3,(H,26,27)