3-(2-azanylethyl)-1-(2-methylprop-2-enoyl)-4,5,7-trinitro-9-oxidanylidene-fluorene-2-carboxylate

Systemtic Name: 3-(2-azanylethyl)-1-(2-methylprop-2-enoyl)-4,5,7-trinitro-9-oxidanylidene-fluorene-2-carboxylate Openeye Name: 3-(2-aminoethyl)-1-(2-methylprop-2-enoyl)-4,5,7-trinitro-9-oxo-fluorene-2-carboxylate CAS Name: 3-(2-aminoethyl)-1-(2-methyl-1-oxoprop-2-enyl)-4,5,7-trinitro-9-oxo-2-fluorenecarboxylate IUPAC Name: 3-(2-aminoethyl)-1-(2-methylprop-2-enoyl)-4,5,7-trinitro-9-oxofluorene-2-carboxylate Traditional Name: 3-(2-aminoethyl)-9-keto-1-methacryloyl-4,5,7-trinitro-fluorene-2-carboxylate Formula: C20H13N4O10- MolecularWeight: 469.33802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)C1=C(C(=C(C2=C1C(=O)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CCN)C(=O)[O-]

Isomeric SMILES

CC(=C)C(=O)C1=C(C(=C(C2=C1C(=O)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CCN)C(=O)[O-]

InChI

InChI=1S/C20H14N4O10/c1-7(2)18(25)15-13(20(27)28)9(3-4-21)17(24(33)34)14-12-10(19(26)16(14)15)5-8(22(29)30)6-11(12)23(31)32/h5-6H,1,3-4,21H2,2H3,(H,27,28)/p-1