2-(3-chlorophenyl)-N-[2-(4-methylphenyl)ethyl]-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN5O3/c1-12-5-7-13(8-6-12)9-10-19-16-17(23(25)26)20-21(22(16)24)15-4-2-3-14(18)11-15/h2-8,11,24H,9-10H2,1H3