(5-nitrofuran-2-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (5-nitrofuran-2-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (5-nitro-2-furyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-nitro-2-furanyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-nitrofuran-2-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (5-nitro-2-furyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C16H13F3N4O6 MolecularWeight: 414.29283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H13F3N4O6/c17-16(18,19)10-1-2-11(12(9-10)22(25)26)20-5-7-21(8-6-20)15(24)13-3-4-14(29-13)23(27)28/h1-4,9H,5-8H2