undecyl 2,5,7-trinitro-9-oxidanylidene-fluorene-4-carboxylate

Systemtic Name: undecyl 2,5,7-trinitro-9-oxidanylidene-fluorene-4-carboxylate Openeye Name: undecyl 2,5,7-trinitro-9-oxo-fluorene-4-carboxylate CAS Name: 2,5,7-trinitro-9-oxo-4-fluorenecarboxylic acid undecyl ester IUPAC Name: undecyl 2,5,7-trinitro-9-oxofluorene-4-carboxylate Traditional Name: 9-keto-2,5,7-trinitro-fluorene-4-carboxylic acid undecyl ester Formula: C25H27N3O9 MolecularWeight: 513.49658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O9/c1-2-3-4-5-6-7-8-9-10-11-37-25(30)20-14-16(26(31)32)12-18-22(20)23-19(24(18)29)13-17(27(33)34)15-21(23)28(35)36/h12-15H,2-11H2,1H3