2,4,5,7-tetranitrofluoren-9-one; 2,4,7-trinitrofluoren-9-one

Systemtic Name: 2,4,5,7-tetranitrofluoren-9-one; 2,4,7-trinitrofluoren-9-one Openeye Name: 2,4,5,7-tetranitrofluoren-9-one; 2,4,7-trinitrofluoren-9-one CAS Name: 2,4,5,7-tetranitro-9-fluorenone; 2,4,7-trinitro-9-fluorenone IUPAC Name: 2,4,5,7-tetranitrofluoren-9-one; 2,4,7-trinitrofluoren-9-one Traditional Name: 2,4,5,7-tetranitrofluoren-9-one; 2,4,7-trinitrofluoren-9-one Formula: C26H9N7O16 MolecularWeight: 675.38696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3C2=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3C2=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H4N4O9.C13H5N3O7/c18-13-7-1-5(14(19)20)3-9(16(23)24)11(7)12-8(13)2-6(15(21)22)4-10(12)17(25)26;17-13-9-3-6(14(18)19)1-2-8(9)12-10(13)4-7(15(20)21)5-11(12)16(22)23/h1-4H;1-5H