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

Systemtic Name: 2-(4-chlorophenyl)-5-nitro-3-oxidanyl-N-(pyridin-3-ylmethyl)-1,2,3-triazol-4-imine Openeye Name: 2-(4-chlorophenyl)-3-hydroxy-5-nitro-N-(3-pyridylmethyl)triazol-4-imine CAS Name: 2-(4-chlorophenyl)-3-hydroxy-5-nitro-N-(3-pyridinylmethyl)-4-triazolimine IUPAC Name: 2-(4-chlorophenyl)-3-hydroxy-5-nitro-N-(pyridin-3-ylmethyl)triazol-4-imine Traditional Name: [2-(4-chlorophenyl)-3-hydroxy-5-nitro-triazol-4-ylidene]-(3-pyridylmethyl)amine Formula: C14H11ClN6O3 MolecularWeight: 346.72854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN6O3/c15-11-3-5-12(6-4-11)19-18-14(21(23)24)13(20(19)22)17-9-10-2-1-7-16-8-10/h1-8,22H,9H2