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

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

Systemtic Name:4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
Openeye Name:4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
CAS Name:4-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole
IUPAC Name:4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole
Traditional Name:4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]sulfonylbenzofurazan
Formula: C17H14F3N5O5S
MolecularWeight: 457.38377
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C3=CC=CC4=NON=C43


Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C3=CC=CC4=NON=C43


InChI

InChI=1S/C17H14F3N5O5S/c18-17(19,20)11-4-5-13(14(10-11)25(26)27)23-6-8-24(9-7-23)31(28,29)15-3-1-2-12-16(15)22-30-21-12/h1-5,10H,6-9H2


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