(3,5-diacetyloxy-2,4,6-trinitro-phenyl) ethanoate

Systemtic Name: (3,5-diacetyloxy-2,4,6-trinitro-phenyl) ethanoate Openeye Name: (3,5-diacetoxy-2,4,6-trinitro-phenyl) acetate CAS Name: acetic acid (3,5-diacetyloxy-2,4,6-trinitrophenyl) ester IUPAC Name: (3,5-diacetyloxy-2,4,6-trinitrophenyl) acetate Traditional Name: acetic acid (3,5-diacetoxy-2,4,6-trinitro-phenyl) ester Formula: C12H9N3O12 MolecularWeight: 387.21276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C(=C1[N+](=O)[O-])OC(=O)C)[N+](=O)[O-])OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=C(C(=C(C(=C1[N+](=O)[O-])OC(=O)C)[N+](=O)[O-])OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O12/c1-4(16)25-10-7(13(19)20)11(26-5(2)17)9(15(23)24)12(27-6(3)18)8(10)14(21)22/h1-3H3