[3-acetyloxy-3-(4-bromophenyl)-2-nitro-propyl] ethanoate

Systemtic Name: [3-acetyloxy-3-(4-bromophenyl)-2-nitro-propyl] ethanoate Openeye Name: [3-acetoxy-3-(4-bromophenyl)-2-nitro-propyl] acetate CAS Name: acetic acid [3-acetyloxy-3-(4-bromophenyl)-2-nitropropyl] ester IUPAC Name: [3-acetyloxy-3-(4-bromophenyl)-2-nitropropyl] acetate Traditional Name: acetic acid [3-acetoxy-3-(4-bromophenyl)-2-nitro-propyl] ester Formula: C13H14BrNO6 MolecularWeight: 360.15736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C1=CC=C(C=C1)Br)OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCC(C(C1=CC=C(C=C1)Br)OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14BrNO6/c1-8(16)20-7-12(15(18)19)13(21-9(2)17)10-3-5-11(14)6-4-10/h3-6,12-13H,7H2,1-2H3