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

Systemtic Name: [2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)-4-oxidanylidene-butyl] ethanoate Openeye Name: [2-acetamido-2-(acetoxymethyl)-4-(4-octylphenyl)-4-oxo-butyl] acetate CAS Name: acetic acid [2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)-4-oxobutyl] ester IUPAC Name: [2-acetamido-2-(acetyloxymethyl)-4-(4-octylphenyl)-4-oxobutyl] acetate Traditional Name: acetic acid [2-acetamido-2-(acetoxymethyl)-4-keto-4-(4-octylphenyl)butyl] ester Formula: C25H37NO6 MolecularWeight: 447.56438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37NO6/c1-5-6-7-8-9-10-11-22-12-14-23(15-13-22)24(30)16-25(26-19(2)27,17-31-20(3)28)18-32-21(4)29/h12-15H,5-11,16-18H2,1-4H3,(H,26,27)