4-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-2,1,3-benzoxadiazole

Systemtic Name: 4-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-2,1,3-benzoxadiazole Openeye Name: 4-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-2,1,3-benzoxadiazole CAS Name: 4-nitro-7-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-2,1,3-benzoxadiazole IUPAC Name: 4-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-2,1,3-benzoxadiazole Traditional Name: 4-nitro-7-[4-[3-(trifluoromethyl)phenyl]piperazino]benzofurazan Formula: C17H14F3N5O3 MolecularWeight: 393.31997

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

InChI

InChI=1S/C17H14F3N5O3/c18-17(19,20)11-2-1-3-12(10-11)23-6-8-24(9-7-23)13-4-5-14(25(26)27)16-15(13)21-28-22-16/h1-5,10H,6-9H2