[1-(4-bromophenyl)-3,3-dimethoxy-2-nitro-propyl] ethanoate

Systemtic Name: [1-(4-bromophenyl)-3,3-dimethoxy-2-nitro-propyl] ethanoate Openeye Name: [1-(4-bromophenyl)-3,3-dimethoxy-2-nitro-propyl] acetate CAS Name: acetic acid [1-(4-bromophenyl)-3,3-dimethoxy-2-nitropropyl] ester IUPAC Name: [1-(4-bromophenyl)-3,3-dimethoxy-2-nitropropyl] acetate Traditional Name: acetic acid [1-(4-bromophenyl)-3,3-dimethoxy-2-nitro-propyl] ester Formula: C13H16BrNO6 MolecularWeight: 362.17324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO6/c1-8(16)21-12(9-4-6-10(14)7-5-9)11(15(17)18)13(19-2)20-3/h4-7,11-13H,1-3H3