N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-2-(3-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-2-(3-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-imine CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-3-hydroxy-2-(3-methylphenyl)-5-nitro-4-triazolimine IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-3-hydroxy-2-(3-methylphenyl)-5-nitrotriazol-4-imine Traditional Name: (2-chloro-4-fluoro-benzyl)-[3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-ylidene]amine Formula: C16H13ClFN5O3 MolecularWeight: 377.757523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2N=C(C(=NCC3=C(C=C(C=C3)F)Cl)N2O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2N=C(C(=NCC3=C(C=C(C=C3)F)Cl)N2O)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClFN5O3/c1-10-3-2-4-13(7-10)21-20-16(23(25)26)15(22(21)24)19-9-11-5-6-12(18)8-14(11)17/h2-8,24H,9H2,1H3