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

Systemtic Name: 2-(3-chlorophenyl)-N-(2,3-dimethylcyclohexyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: 2-(3-chlorophenyl)-N-(2,3-dimethylcyclohexyl)-3-hydroxy-5-nitro-triazol-4-imine CAS Name: 2-(3-chlorophenyl)-N-(2,3-dimethylcyclohexyl)-3-hydroxy-5-nitro-4-triazolimine IUPAC Name: 2-(3-chlorophenyl)-N-(2,3-dimethylcyclohexyl)-3-hydroxy-5-nitrotriazol-4-imine Traditional Name: [2-(3-chlorophenyl)-3-hydroxy-5-nitro-triazol-4-ylidene]-(2,3-dimethylcyclohexyl)amine Formula: C16H20ClN5O3 MolecularWeight: 365.8147

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N=C2C(=NN(N2O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCC(C1C)N=C2C(=NN(N2O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H20ClN5O3/c1-10-5-3-8-14(11(10)2)18-15-16(22(24)25)19-20(21(15)23)13-7-4-6-12(17)9-13/h4,6-7,9-11,14,23H,3,5,8H2,1-2H3