5-[(4-bromanylphenoxy)methyl]-3-(4-chloranyl-3-nitro-phenyl)-1H-1,2,4-triazole

Systemtic Name: 5-[(4-bromanylphenoxy)methyl]-3-(4-chloranyl-3-nitro-phenyl)-1H-1,2,4-triazole Openeye Name: 5-[(4-bromophenoxy)methyl]-3-(4-chloro-3-nitro-phenyl)-1H-1,2,4-triazole CAS Name: 5-[(4-bromophenoxy)methyl]-3-(4-chloro-3-nitrophenyl)-1H-1,2,4-triazole IUPAC Name: 5-[(4-bromophenoxy)methyl]-3-(4-chloro-3-nitrophenyl)-1H-1,2,4-triazole Traditional Name: 5-[(4-bromophenoxy)methyl]-3-(4-chloro-3-nitro-phenyl)-1H-1,2,4-triazole Formula: C15H10BrClN4O3 MolecularWeight: 409.6219

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC2=NC(=NN2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1OCC2=NC(=NN2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C15H10BrClN4O3/c16-10-2-4-11(5-3-10)24-8-14-18-15(20-19-14)9-1-6-12(17)13(7-9)21(22)23/h1-7H,8H2,(H,18,19,20)