2-(4-chlorophenyl)-N-(2-methyl-4-nitro-phenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

Systemtic Name: 2-(4-chlorophenyl)-N-(2-methyl-4-nitro-phenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-N-(2-methyl-4-nitro-phenyl)-5-nitro-triazol-4-imine CAS Name: 2-(4-chlorophenyl)-3-hydroxy-N-(2-methyl-4-nitrophenyl)-5-nitro-4-triazolimine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxy-N-(2-methyl-4-nitrophenyl)-5-nitrotriazol-4-imine Traditional Name: [2-(4-chlorophenyl)-3-hydroxy-5-nitro-triazol-4-ylidene]-(2-methyl-4-nitro-phenyl)amine Formula: C15H11ClN6O5 MolecularWeight: 390.73804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N=C2C(=NN(N2O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N=C2C(=NN(N2O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClN6O5/c1-9-8-12(21(24)25)6-7-13(9)17-14-15(22(26)27)18-19(20(14)23)11-4-2-10(16)3-5-11/h2-8,23H,1H3