[2-acetamido-2-(acetyloxymethyl)-4-[4-(5-phenylpentoxymethyl)phenyl]butyl] ethanoate

Systemtic Name: [2-acetamido-2-(acetyloxymethyl)-4-[4-(5-phenylpentoxymethyl)phenyl]butyl] ethanoate Openeye Name: [2-acetamido-2-(acetoxymethyl)-4-[4-(5-phenylpentoxymethyl)phenyl]butyl] acetate CAS Name: acetic acid [2-acetamido-2-(acetyloxymethyl)-4-[4-(5-phenylpentoxymethyl)phenyl]butyl] ester IUPAC Name: [2-acetamido-2-(acetyloxymethyl)-4-[4-(5-phenylpentoxymethyl)phenyl]butyl] acetate Traditional Name: acetic acid [2-acetamido-2-(acetoxymethyl)-4-[4-(5-phenylpentoxymethyl)phenyl]butyl] ester Formula: C29H39NO6 MolecularWeight: 497.62306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC1=CC=C(C=C1)COCCCCCC2=CC=CC=C2)(COC(=O)C)COC(=O)C

Isomeric SMILES

CC(=O)NC(CCC1=CC=C(C=C1)COCCCCCC2=CC=CC=C2)(COC(=O)C)COC(=O)C

InChI

InChI=1S/C29H39NO6/c1-23(31)30-29(21-35-24(2)32,22-36-25(3)33)18-17-27-13-15-28(16-14-27)20-34-19-9-5-8-12-26-10-6-4-7-11-26/h4,6-7,10-11,13-16H,5,8-9,12,17-22H2,1-3H3,(H,30,31)