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

Systemtic Name: [2-acetamido-2-(acetyloxymethyl)-4-(4-bromophenyl)butyl] ethanoate Openeye Name: [2-acetamido-2-(acetoxymethyl)-4-(4-bromophenyl)butyl] acetate CAS Name: acetic acid [2-acetamido-2-(acetyloxymethyl)-4-(4-bromophenyl)butyl] ester IUPAC Name: [2-acetamido-2-(acetyloxymethyl)-4-(4-bromophenyl)butyl] acetate Traditional Name: acetic acid [2-acetamido-2-(acetoxymethyl)-4-(4-bromophenyl)butyl] ester Formula: C17H22BrNO5 MolecularWeight: 400.26428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC1=CC=C(C=C1)Br)(COC(=O)C)COC(=O)C

Isomeric SMILES

CC(=O)NC(CCC1=CC=C(C=C1)Br)(COC(=O)C)COC(=O)C

InChI

InChI=1S/C17H22BrNO5/c1-12(20)19-17(10-23-13(2)21,11-24-14(3)22)9-8-15-4-6-16(18)7-5-15/h4-7H,8-11H2,1-3H3,(H,19,20)