[2-methyl-4,6-dinitro-3-(phenylcarbonyl)-1-benzofuran-5-yl] ethanoate

Systemtic Name: [2-methyl-4,6-dinitro-3-(phenylcarbonyl)-1-benzofuran-5-yl] ethanoate Openeye Name: (3-benzoyl-2-methyl-4,6-dinitro-benzofuran-5-yl) acetate CAS Name: acetic acid (3-benzoyl-2-methyl-4,6-dinitro-5-benzofuranyl) ester IUPAC Name: (3-benzoyl-2-methyl-4,6-dinitro-1-benzofuran-5-yl) acetate Traditional Name: acetic acid (3-benzoyl-2-methyl-4,6-dinitro-benzofuran-5-yl) ester Formula: C18H12N2O8 MolecularWeight: 384.29648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=C(C(=C2[N+](=O)[O-])OC(=O)C)[N+](=O)[O-])C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(O1)C=C(C(=C2[N+](=O)[O-])OC(=O)C)[N+](=O)[O-])C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H12N2O8/c1-9-14(17(22)11-6-4-3-5-7-11)15-13(27-9)8-12(19(23)24)18(28-10(2)21)16(15)20(25)26/h3-8H,1-2H3