4,6-dinitro-1-oxidanyl-N,2-bis[4-(trifluoromethyloxy)phenyl]indazol-3-imine

Systemtic Name: 4,6-dinitro-1-oxidanyl-N,2-bis[4-(trifluoromethyloxy)phenyl]indazol-3-imine Openeye Name: 1-hydroxy-4,6-dinitro-N,2-bis[4-(trifluoromethoxy)phenyl]indazol-3-imine CAS Name: 1-hydroxy-4,6-dinitro-N,2-bis[4-(trifluoromethoxy)phenyl]-3-indazolimine IUPAC Name: 1-hydroxy-4,6-dinitro-N,2-bis[4-(trifluoromethoxy)phenyl]indazol-3-imine Traditional Name: [1-hydroxy-4,6-dinitro-2-[4-(trifluoromethoxy)phenyl]indazolin-3-ylidene]-[4-(trifluoromethoxy)phenyl]amine Formula: C21H11F6N5O7 MolecularWeight: 559.331759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=C2C3=C(C=C(C=C3N(N2C4=CC=C(C=C4)OC(F)(F)F)O)[N+](=O)[O-])[N+](=O)[O-])OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1N=C2C3=C(C=C(C=C3N(N2C4=CC=C(C=C4)OC(F)(F)F)O)[N+](=O)[O-])[N+](=O)[O-])OC(F)(F)F

InChI

InChI=1S/C21H11F6N5O7/c22-20(23,24)38-14-5-1-11(2-6-14)28-19-18-16(9-13(31(34)35)10-17(18)32(36)37)30(33)29(19)12-3-7-15(8-4-12)39-21(25,26)27/h1-10,33H