1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[(Z)-1-methylsulfanyl-2-nitro-ethenyl]piperazine

Systemtic Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[(Z)-1-methylsulfanyl-2-nitro-ethenyl]piperazine Openeye Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[(Z)-1-methylsulfanyl-2-nitro-vinyl]piperazine CAS Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[(Z)-1-(methylthio)-2-nitroethenyl]piperazine IUPAC Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[(Z)-1-methylsulfanyl-2-nitroethenyl]piperazine Traditional Name: 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-[(Z)-1-(methylthio)-2-nitro-vinyl]piperazine Formula: C14H14F3N5O6S MolecularWeight: 437.35107

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C[N+](=O)[O-])N1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CS/C(=C\[N+](=O)[O-])/N1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H14F3N5O6S/c1-29-12(8-20(23)24)18-2-4-19(5-3-18)13-10(21(25)26)6-9(14(15,16)17)7-11(13)22(27)28/h6-8H,2-5H2,1H3/b12-8-