[2-bromanyl-2-nitro-3-(phenylcarbonyloxy)propyl] benzoate

Systemtic Name: [2-bromanyl-2-nitro-3-(phenylcarbonyloxy)propyl] benzoate Openeye Name: (3-benzoyloxy-2-bromo-2-nitro-propyl) benzoate CAS Name: benzoic acid (3-benzoyloxy-2-bromo-2-nitropropyl) ester IUPAC Name: (3-benzoyloxy-2-bromo-2-nitropropyl) benzoate Traditional Name: benzoic acid (3-benzoyloxy-2-bromo-2-nitro-propyl) ester Formula: C17H14BrNO6 MolecularWeight: 408.20016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)([N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)([N+](=O)[O-])Br

InChI

InChI=1S/C17H14BrNO6/c18-17(19(22)23,11-24-15(20)13-7-3-1-4-8-13)12-25-16(21)14-9-5-2-6-10-14/h1-10H,11-12H2