2,7-dinitro-9-oxidanylidene-fluorene-4-carboxylic acid; propanedinitrile

Systemtic Name: 2,7-dinitro-9-oxidanylidene-fluorene-4-carboxylic acid; propanedinitrile Openeye Name: 2,7-dinitro-9-oxo-fluorene-4-carboxylic acid; propanedinitrile CAS Name: 2,7-dinitro-9-oxo-4-fluorenecarboxylic acid; propanedinitrile IUPAC Name: 2,7-dinitro-9-oxofluorene-4-carboxylic acid; propanedinitrile Traditional Name: 9-keto-2,7-dinitro-fluorene-4-carboxylic acid; malononitrile Formula: C17H8N4O7 MolecularWeight: 380.26802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)C(=O)O)[N+](=O)[O-].C(C#N)C#N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)C(=O)O)[N+](=O)[O-].C(C#N)C#N

InChI

InChI=1S/C14H6N2O7.C3H2N2/c17-13-9-3-6(15(20)21)1-2-8(9)12-10(13)4-7(16(22)23)5-11(12)14(18)19;4-2-1-3-5/h1-5H,(H,18,19);1H2