2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-phenyl-pyrazolidin-3-imine

Systemtic Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-phenyl-pyrazolidin-3-imine Openeye Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-phenyl-pyrazolidin-3-imine CAS Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-phenyl-3-pyrazolidinimine IUPAC Name: 2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-phenylpyrazolidin-3-imine Traditional Name: [2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-phenyl-pyrazolidin-3-ylidene]amine Formula: C16H12F3N5O4 MolecularWeight: 395.29279

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1=N)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CN(N(C1=N)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H12F3N5O4/c17-16(18,19)10-8-12(23(25)26)15(13(9-10)24(27)28)22-14(20)6-7-21(22)11-4-2-1-3-5-11/h1-5,8-9,20H,6-7H2