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

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-5-nitro-3-oxidanyl-2-phenyl-1,2,3-triazol-4-imine Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-hydroxy-5-nitro-2-phenyl-triazol-4-imine CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-5-nitro-2-phenyl-4-triazolimine IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-5-nitro-2-phenyltriazol-4-imine Traditional Name: (4-chloro-2-methoxy-5-methyl-phenyl)-(3-hydroxy-5-nitro-2-phenyl-triazol-4-ylidene)amine Formula: C16H14ClN5O4 MolecularWeight: 375.76646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN5O4/c1-10-8-13(14(26-2)9-12(10)17)18-15-16(22(24)25)19-20(21(15)23)11-6-4-3-5-7-11/h3-9,23H,1-2H3