propan-2-yl 9-(dicyanomethylidene)-2,5,7-trinitro-fluorene-4-carboxylate

Systemtic Name: propan-2-yl 9-(dicyanomethylidene)-2,5,7-trinitro-fluorene-4-carboxylate Openeye Name: isopropyl 9-(dicyanomethylene)-2,5,7-trinitro-fluorene-4-carboxylate CAS Name: 9-(dicyanomethylidene)-2,5,7-trinitro-4-fluorenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 9-(dicyanomethylidene)-2,5,7-trinitrofluorene-4-carboxylate Traditional Name: 9-(dicyanomethylene)-2,5,7-trinitro-fluorene-4-carboxylic acid isopropyl ester Formula: C20H11N5O8 MolecularWeight: 449.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=C(C#N)C#N)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=C(C#N)C#N)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H11N5O8/c1-9(2)33-20(26)15-5-11(23(27)28)3-13-17(10(7-21)8-22)14-4-12(24(29)30)6-16(25(31)32)19(14)18(13)15/h3-6,9H,1-2H3