4-(azepan-1-ylcarbonyl)-2,7-dinitro-fluoren-9-one

Systemtic Name: 4-(azepan-1-ylcarbonyl)-2,7-dinitro-fluoren-9-one Openeye Name: 4-(azepane-1-carbonyl)-2,7-dinitro-fluoren-9-one CAS Name: 4-[1-azepanyl(oxo)methyl]-2,7-dinitro-9-fluorenone IUPAC Name: 4-(azepane-1-carbonyl)-2,7-dinitrofluoren-9-one Traditional Name: 4-(azepane-1-carbonyl)-2,7-dinitro-fluoren-9-one Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C3C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)C3=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C3C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)C3=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O6/c24-19-15-9-12(22(26)27)5-6-14(15)18-16(19)10-13(23(28)29)11-17(18)20(25)21-7-3-1-2-4-8-21/h5-6,9-11H,1-4,7-8H2