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

Systemtic Name: 4,6-dinitro-1-oxidanyl-N,2-bis[3-(trifluoromethyl)phenyl]indazol-3-imine Openeye Name: 1-hydroxy-4,6-dinitro-N,2-bis[3-(trifluoromethyl)phenyl]indazol-3-imine CAS Name: 1-hydroxy-4,6-dinitro-N,2-bis[3-(trifluoromethyl)phenyl]-3-indazolimine IUPAC Name: 1-hydroxy-4,6-dinitro-N,2-bis[3-(trifluoromethyl)phenyl]indazol-3-imine Traditional Name: [1-hydroxy-4,6-dinitro-2-[3-(trifluoromethyl)phenyl]indazolin-3-ylidene]-[3-(trifluoromethyl)phenyl]amine Formula: C21H11F6N5O5 MolecularWeight: 527.332959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H11F6N5O5/c22-20(23,24)11-3-1-5-13(7-11)28-19-18-16(9-15(31(34)35)10-17(18)32(36)37)30(33)29(19)14-6-2-4-12(8-14)21(25,26)27/h1-10,33H