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

Systemtic Name: decyl 9-(dicyanomethylidene)-4,5,7-trinitro-fluorene-2-carboxylate Openeye Name: decyl 9-(dicyanomethylene)-4,5,7-trinitro-fluorene-2-carboxylate CAS Name: 9-(dicyanomethylidene)-4,5,7-trinitro-2-fluorenecarboxylic acid decyl ester IUPAC Name: decyl 9-(dicyanomethylidene)-4,5,7-trinitrofluorene-2-carboxylate Traditional Name: 9-(dicyanomethylene)-4,5,7-trinitro-fluorene-2-carboxylic acid decyl ester Formula: C27H25N5O8 MolecularWeight: 547.5161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O8/c1-2-3-4-5-6-7-8-9-10-40-27(33)17-11-20-24(18(15-28)16-29)21-13-19(30(34)35)14-23(32(38)39)26(21)25(20)22(12-17)31(36)37/h11-14H,2-10H2,1H3