undecyl 9-(dicyanomethylidene)-2,7-dinitro-fluorene-4-carboxylate

Systemtic Name: undecyl 9-(dicyanomethylidene)-2,7-dinitro-fluorene-4-carboxylate Openeye Name: undecyl 9-(dicyanomethylene)-2,7-dinitro-fluorene-4-carboxylate CAS Name: 9-(dicyanomethylidene)-2,7-dinitro-4-fluorenecarboxylic acid undecyl ester IUPAC Name: undecyl 9-(dicyanomethylidene)-2,7-dinitrofluorene-4-carboxylate Traditional Name: 9-(dicyanomethylene)-2,7-dinitro-fluorene-4-carboxylic acid undecyl ester Formula: C28H28N4O6 MolecularWeight: 516.54512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(=C(C#N)C#N)C2=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(=C(C#N)C#N)C2=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O6/c1-2-3-4-5-6-7-8-9-10-13-38-28(33)25-16-21(32(36)37)15-24-26(19(17-29)18-30)23-14-20(31(34)35)11-12-22(23)27(24)25/h11-12,14-16H,2-10,13H2,1H3