5-[(4-bromanylphenoxy)methyl]-3-(4-methylphenyl)-1H-1,2,4-triazole

Systemtic Name: 5-[(4-bromanylphenoxy)methyl]-3-(4-methylphenyl)-1H-1,2,4-triazole Openeye Name: 5-[(4-bromophenoxy)methyl]-3-(p-tolyl)-1H-1,2,4-triazole CAS Name: 5-[(4-bromophenoxy)methyl]-3-(4-methylphenyl)-1H-1,2,4-triazole IUPAC Name: 5-[(4-bromophenoxy)methyl]-3-(4-methylphenyl)-1H-1,2,4-triazole Traditional Name: 5-[(4-bromophenoxy)methyl]-3-(p-tolyl)-1H-1,2,4-triazole Formula: C16H14BrN3O MolecularWeight: 344.20586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=N2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=N2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN3O/c1-11-2-4-12(5-3-11)16-18-15(19-20-16)10-21-14-8-6-13(17)7-9-14/h2-9H,10H2,1H3,(H,18,19,20)