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

Systemtic Name: hexyl 9-(dicyanomethylidene)-2,5,7-trinitro-fluorene-4-carboxylate Openeye Name: hexyl 9-(dicyanomethylene)-2,5,7-trinitro-fluorene-4-carboxylate CAS Name: 9-(dicyanomethylidene)-2,5,7-trinitro-4-fluorenecarboxylic acid hexyl ester IUPAC Name: hexyl 9-(dicyanomethylidene)-2,5,7-trinitrofluorene-4-carboxylate Traditional Name: 9-(dicyanomethylene)-2,5,7-trinitro-fluorene-4-carboxylic acid hexyl ester Formula: C23H17N5O8 MolecularWeight: 491.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=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

CCCCCCOC(=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/C23H17N5O8/c1-2-3-4-5-6-36-23(29)18-9-14(26(30)31)7-16-20(13(11-24)12-25)17-8-15(27(32)33)10-19(28(34)35)22(17)21(16)18/h7-10H,2-6H2,1H3