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

Systemtic Name: octyl 9-(dicyanomethylidene)-2,7-dinitro-fluorene-4-carboxylate Openeye Name: octyl 9-(dicyanomethylene)-2,7-dinitro-fluorene-4-carboxylate CAS Name: 9-(dicyanomethylidene)-2,7-dinitro-4-fluorenecarboxylic acid octyl ester IUPAC Name: octyl 9-(dicyanomethylidene)-2,7-dinitrofluorene-4-carboxylate Traditional Name: 9-(dicyanomethylene)-2,7-dinitro-fluorene-4-carboxylic acid octyl ester Formula: C25H22N4O6 MolecularWeight: 474.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=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

CCCCCCCCOC(=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/C25H22N4O6/c1-2-3-4-5-6-7-10-35-25(30)22-13-18(29(33)34)12-21-23(16(14-26)15-27)20-11-17(28(31)32)8-9-19(20)24(21)22/h8-9,11-13H,2-7,10H2,1H3