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

Systemtic Name: (5-bromanylfuran-2-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (5-bromo-2-furyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-bromo-2-furanyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-bromofuran-2-yl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (5-bromo-2-furyl)-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C16H13BrF3N3O4 MolecularWeight: 448.19133

Click to see the large picture

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)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrF3N3O4/c17-14-4-3-13(27-14)15(24)22-7-5-21(6-8-22)11-2-1-10(16(18,19)20)9-12(11)23(25)26/h1-4,9H,5-8H2