2-(3-chlorophenyl)-5-nitro-3-oxidanyl-N-(4-propan-2-ylphenyl)-1,2,3-triazol-4-imine

Systemtic Name: 2-(3-chlorophenyl)-5-nitro-3-oxidanyl-N-(4-propan-2-ylphenyl)-1,2,3-triazol-4-imine Openeye Name: 2-(3-chlorophenyl)-3-hydroxy-N-(4-isopropylphenyl)-5-nitro-triazol-4-imine CAS Name: 2-(3-chlorophenyl)-3-hydroxy-5-nitro-N-(4-propan-2-ylphenyl)-4-triazolimine IUPAC Name: 2-(3-chlorophenyl)-3-hydroxy-5-nitro-N-(4-propan-2-ylphenyl)triazol-4-imine Traditional Name: [2-(3-chlorophenyl)-3-hydroxy-5-nitro-triazol-4-ylidene]-p-cumenyl-amine Formula: C17H16ClN5O3 MolecularWeight: 373.79364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN5O3/c1-11(2)12-6-8-14(9-7-12)19-16-17(23(25)26)20-21(22(16)24)15-5-3-4-13(18)10-15/h3-11,24H,1-2H3