propanedinitrile; 2,4,7-trinitro-9H-fluorene

Systemtic Name: propanedinitrile; 2,4,7-trinitro-9H-fluorene Openeye Name: propanedinitrile; 2,4,7-trinitro-9H-fluorene CAS Name: propanedinitrile; 2,4,7-trinitro-9H-fluorene IUPAC Name: propanedinitrile; 2,4,7-trinitro-9H-fluorene Traditional Name: malononitrile; 2,4,7-trinitro-9H-fluorene Formula: C16H9N5O6 MolecularWeight: 367.27256

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2C3=C1C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C(C#N)C#N

Isomeric SMILES

C1C2=CC(=CC(=C2C3=C1C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C(C#N)C#N

InChI

InChI=1S/C13H7N3O6.C3H2N2/c17-14(18)9-1-2-11-7(4-9)3-8-5-10(15(19)20)6-12(13(8)11)16(21)22;4-2-1-3-5/h1-2,4-6H,3H2;1H2